CAS RN: 59922-36-0
CAS Name: 1,4-dimethoxy-1-methyl-4-propan-2-ylcyclohexane
OPENEYE Name: 1-isopropyl-1,4-dimethoxy-4-methyl-cyclohexane
IUPAC Name: 1,4-dimethoxy-1-methyl-4-propan-2-ylcyclohexane
SYSTEMATIC NAME: 1,4-dimethoxy-1-methyl-4-propan-2-yl-cyclohexane
MOLECULAR FORMULA: C12H24O2
MOLECULAR WEIGHT: 200.31776
SMILES: CC(C)C1(CCC(CC1)(C)OC)OC
Structure:
CAS RN: 59921-42-5
CAS Name: 1-[3,4-dimethoxy-5-(methoxymethyl)-2-oxolanyl]-4-(dimethylamino)-2-pyrimidinone
OPENEYE Name: 1-[3,4-dimethoxy-5-(methoxymethyl)tetrahydrofuran-2-yl]-4-(dimethylamino)pyrimidin-2-one
IUPAC Name: 1-[3,4-dimethoxy-5-(methoxymethyl)oxolan-2-yl]-4-(dimethylamino)pyrimidin-2-one
SYSTEMATIC NAME: 1-[3,4-dimethoxy-5-(methoxymethyl)oxolan-2-yl]-4-(dimethylamino)pyrimidin-2-one
MOLECULAR FORMULA: C14H23N3O5
MOLECULAR WEIGHT: 313.34952
SMILES: CN(C)C1=NC(=O)N(C=C1)C2C(C(C(O2)COC)OC)OC
Structure:
CAS RN: 59889-45-1
CAS Name: 2-chloro-2,3-dimethylpentane
OPENEYE Name: 2-chloro-2,3-dimethyl-pentane
IUPAC Name: 2-chloro-2,3-dimethylpentane
SYSTEMATIC NAME: 2-chloranyl-2,3-dimethyl-pentane
MOLECULAR FORMULA: C7H15Cl
MOLECULAR WEIGHT: 134.647
SMILES: CCC(C)C(C)(C)Cl
Structure:
CAS RN: 59880-84-1
CAS Name: 1,4-dimethoxybicyclo[2.2.2]octane
OPENEYE Name: 1,4-dimethoxybicyclo[2.2.2]octane
IUPAC Name: 1,4-dimethoxybicyclo[2.2.2]octane
SYSTEMATIC NAME: 1,4-dimethoxybicyclo[2.2.2]octane
MOLECULAR FORMULA: C10H18O2
MOLECULAR WEIGHT: 170.24872
SMILES: COC12CCC(CC1)(CC2)OC
Structure:
CAS RN: 59880-83-0
CAS Name: 1-methyl-5-propan-2-yl-2,4-dioxabicyclo[3.2.2]nonane
OPENEYE Name: 5-isopropyl-1-methyl-2,4-dioxabicyclo[3.2.2]nonane
IUPAC Name: 1-methyl-5-propan-2-yl-2,4-dioxabicyclo[3.2.2]nonane
SYSTEMATIC NAME: 1-methyl-5-propan-2-yl-2,4-dioxabicyclo[3.2.2]nonane
MOLECULAR FORMULA: C11H20O2
MOLECULAR WEIGHT: 184.2753
SMILES: CC(C)C12CCC(CC1)(OCO2)C
Structure:
CAS RN: 59880-82-9
CAS Name: 1,4-dimethoxybicyclo[2.2.2]oct-2-ene
OPENEYE Name: 1,4-dimethoxybicyclo[2.2.2]oct-2-ene
IUPAC Name: 1,4-dimethoxybicyclo[2.2.2]oct-2-ene
SYSTEMATIC NAME: 1,4-dimethoxybicyclo[2.2.2]oct-2-ene
MOLECULAR FORMULA: C10H16O2
MOLECULAR WEIGHT: 168.23284
SMILES: COC12CCC(CC1)(C=C2)OC
Structure:
CAS RN: 59880-81-8
CAS Name: 3,6-dimethoxy-3-methyl-6-propan-2-ylcyclohexene
OPENEYE Name: 3-isopropyl-3,6-dimethoxy-6-methyl-cyclohexene
IUPAC Name: 3,6-dimethoxy-3-methyl-6-propan-2-ylcyclohexene
SYSTEMATIC NAME: 3,6-dimethoxy-3-methyl-6-propan-2-yl-cyclohexene
MOLECULAR FORMULA: C12H22O2
MOLECULAR WEIGHT: 198.30188
SMILES: CC(C)C1(CCC(C=C1)(C)OC)OC
Structure:
CAS RN: 59880-80-7
CAS Name: 1-methyl-5-propan-2-yl-2,4-dioxabicyclo[3.2.2]non-6-ene
OPENEYE Name: 5-isopropyl-1-methyl-2,4-dioxabicyclo[3.2.2]non-6-ene
IUPAC Name: 1-methyl-5-propan-2-yl-2,4-dioxabicyclo[3.2.2]non-6-ene
SYSTEMATIC NAME: 1-methyl-5-propan-2-yl-2,4-dioxabicyclo[3.2.2]non-6-ene
MOLECULAR FORMULA: C11H18O2
MOLECULAR WEIGHT: 182.25942
SMILES: CC(C)C12CCC(C=C1)(OCO2)C
Structure:
CAS RN: 59804-88-5
CAS Name: 2-(1-methyl-3-pyridin-1-iumyl)-3-oxo-1-indenolate
OPENEYE Name: 2-(1-methylpyridin-1-ium-3-yl)-3-oxo-inden-1-olate
IUPAC Name: 2-(1-methylpyridin-1-ium-3-yl)-3-oxoinden-1-olate
SYSTEMATIC NAME: 2-(1-methylpyridin-1-ium-3-yl)-3-oxidanylidene-inden-1-olate
MOLECULAR FORMULA: C15H11NO2
MOLECULAR WEIGHT: 237.25334
SMILES: C[N+]1=CC=CC(=C1)C2=C(C3=CC=CC=C3C2=O)[O-]
Structure:
CAS RN: 59788-15-7
CAS Name: 2-methylphenanthro[9,10-c]pyrrole
OPENEYE Name: 2-methylphenanthro[9,10-c]pyrrole
IUPAC Name: 2-methylphenanthro[9,10-c]pyrrole
SYSTEMATIC NAME: 2-methylphenanthro[9,10-c]pyrrole
MOLECULAR FORMULA: C17H13N
MOLECULAR WEIGHT: 231.29182
SMILES: CN1C=C2C3=CC=CC=C3C4=CC=CC=C4C2=C1
Structure:
CAS RN: 59788-14-6
CAS Name: 2-methylbenzo[f]isoindole
OPENEYE Name: 2-methylbenzo[f]isoindole
IUPAC Name: 2-methylbenzo[f]isoindole
SYSTEMATIC NAME: 2-methylbenzo[f]isoindole
MOLECULAR FORMULA: C13H11N
MOLECULAR WEIGHT: 181.23314
SMILES: CN1C=C2C=C3C=CC=CC3=CC2=C1
Structure:
CAS RN: 59777-83-2
CAS Name: N,N-dibutyl-1-butanamine; molecular bromine
OPENEYE Name: N,N-dibutylbutan-1-amine; molecular bromine
IUPAC Name: N,N-dibutylbutan-1-amine; molecular bromine
SYSTEMATIC NAME: N,N-dibutylbutan-1-amine; molecular bromine
MOLECULAR FORMULA: C12H27Br2N
MOLECULAR WEIGHT: 345.15748
SMILES: CCCCN(CCCC)CCCC.BrBr
Structure:
CAS RN: 59777-82-1
CAS Name: N,N-dipropyl-1-propanamine; molecular bromine
OPENEYE Name: N,N-dipropylpropan-1-amine; molecular bromine
IUPAC Name: N,N-dipropylpropan-1-amine; molecular bromine
SYSTEMATIC NAME: N,N-dipropylpropan-1-amine; molecular bromine
MOLECULAR FORMULA: C9H21Br2N
MOLECULAR WEIGHT: 303.07774
SMILES: CCCN(CCC)CCC.BrBr
Structure:
CAS RN: 59777-81-0
CAS Name: N-ethyl-N-methylethanamine; molecular bromine
OPENEYE Name: N-ethyl-N-methyl-ethanamine; molecular bromine
IUPAC Name: N-ethyl-N-methylethanamine; molecular bromine
SYSTEMATIC NAME: N-ethyl-N-methyl-ethanamine; molecular bromine
MOLECULAR FORMULA: C5H13Br2N
MOLECULAR WEIGHT: 246.97142
SMILES: CCN(C)CC.BrBr
Structure:
CAS RN: 59734-23-5
CAS Name: 5-methyl-4-octanol
OPENEYE Name: 5-methyloctan-4-ol
IUPAC Name: 5-methyloctan-4-ol
SYSTEMATIC NAME: 5-methyloctan-4-ol
MOLECULAR FORMULA: C9H20O
MOLECULAR WEIGHT: 144.2545
SMILES: CCCC(C)C(CCC)O
Structure:
CAS RN: 59710-71-3
CAS Name: tetradecaneperoxoic acid tert-butyl ester
OPENEYE Name: tert-butyl tetradecaneperoxoate
IUPAC Name: tert-butyl tetradecaneperoxoate
SYSTEMATIC NAME: tert-butyl tetradecaneperoxoate
MOLECULAR FORMULA: C18H36O3
MOLECULAR WEIGHT: 300.47664
SMILES: CCCCCCCCCCCCCC(=O)OOC(C)(C)C
Structure:
CAS RN: 59701-69-8
CAS Name: 5-methoxy-1,2,3,3a-tetrahydrocyclopenta[b]benzofuran-8b-ol
OPENEYE Name: 5-methoxy-1,2,3,3a-tetrahydrocyclopenta[b]benzofuran-8b-ol
IUPAC Name: 5-methoxy-1,2,3,3a-tetrahydrocyclopenta[b][1]benzofuran-8b-ol
SYSTEMATIC NAME: 5-methoxy-1,2,3,3a-tetrahydrocyclopenta[b][1]benzofuran-8b-ol
MOLECULAR FORMULA: C12H14O3
MOLECULAR WEIGHT: 206.23776
SMILES: COC1=CC=CC2=C1OC3C2(CCC3)O
Structure:
CAS RN: 59701-66-5
CAS Name: 4-(2-hydroxy-5-methoxyphenyl)-4-oxobutanoic acid methyl ester
OPENEYE Name: methyl 4-(2-hydroxy-5-methoxy-phenyl)-4-oxo-butanoate
IUPAC Name: methyl 4-(2-hydroxy-5-methoxyphenyl)-4-oxobutanoate
SYSTEMATIC NAME: methyl 4-(5-methoxy-2-oxidanyl-phenyl)-4-oxidanylidene-butanoate
MOLECULAR FORMULA: C12H14O5
MOLECULAR WEIGHT: 238.23656
SMILES: COC1=CC(=C(C=C1)O)C(=O)CCC(=O)OC
Structure:
CAS RN: 59661-03-9
CAS Name: 2-(dichloroamino)-2-methylpropanoic acid octyl ester
OPENEYE Name: octyl 2-(dichloroamino)-2-methyl-propanoate
IUPAC Name: octyl 2-(dichloroamino)-2-methylpropanoate
SYSTEMATIC NAME: octyl 2-[bis(chloranyl)amino]-2-methyl-propanoate
MOLECULAR FORMULA: C12H23Cl2NO2
MOLECULAR WEIGHT: 284.22252
SMILES: CCCCCCCCOC(=O)C(C)(C)N(Cl)Cl
Structure:
CAS RN: 59661-02-8
CAS Name: 2-(dichloroamino)-2-methylpropanoic acid hexyl ester
OPENEYE Name: hexyl 2-(dichloroamino)-2-methyl-propanoate
IUPAC Name: hexyl 2-(dichloroamino)-2-methylpropanoate
SYSTEMATIC NAME: hexyl 2-[bis(chloranyl)amino]-2-methyl-propanoate
MOLECULAR FORMULA: C10H19Cl2NO2
MOLECULAR WEIGHT: 256.16936
SMILES: CCCCCCOC(=O)C(C)(C)N(Cl)Cl
Structure:
CAS RN: 59660-97-8
CAS Name: 2-(chloroamino)-2-methylpropanoic acid octyl ester
OPENEYE Name: octyl 2-(chloroamino)-2-methyl-propanoate
IUPAC Name: octyl 2-(chloroamino)-2-methylpropanoate
SYSTEMATIC NAME: octyl 2-(chloranylamino)-2-methyl-propanoate
MOLECULAR FORMULA: C12H24ClNO2
MOLECULAR WEIGHT: 249.77746
SMILES: CCCCCCCCOC(=O)C(C)(C)NCl
Structure:
CAS RN: 59660-96-7
CAS Name: 2-(chloroamino)-2-methylpropanoic acid hexyl ester
OPENEYE Name: hexyl 2-(chloroamino)-2-methyl-propanoate
IUPAC Name: hexyl 2-(chloroamino)-2-methylpropanoate
SYSTEMATIC NAME: hexyl 2-(chloranylamino)-2-methyl-propanoate
MOLECULAR FORMULA: C10H20ClNO2
MOLECULAR WEIGHT: 221.7243
SMILES: CCCCCCOC(=O)C(C)(C)NCl
Structure:
CAS RN: 59643-45-7
CAS Name: 2,2-dimethylpropyl(2-methylpropyl)mercury
OPENEYE Name: 2,2-dimethylpropyl(isobutyl)mercury
IUPAC Name: 2,2-dimethylpropyl(2-methylpropyl)mercury
SYSTEMATIC NAME: 2,2-dimethylpropyl(2-methylpropyl)mercury
MOLECULAR FORMULA: C9H20Hg
MOLECULAR WEIGHT: 328.8451
SMILES: CC(C)C[Hg]CC(C)(C)C
Structure:
CAS RN: 59643-44-6
CAS Name: methyl(2-methylpropyl)mercury
OPENEYE Name: isobutyl(methyl)mercury
IUPAC Name: methyl(2-methylpropyl)mercury
SYSTEMATIC NAME: methyl(2-methylpropyl)mercury
MOLECULAR FORMULA: C5H12Hg
MOLECULAR WEIGHT: 272.73878
SMILES: CC(C)C[Hg]C
Structure:
CAS RN: 59554-08-4
CAS Name: 2,2-dimethoxy-3-methylbutane
OPENEYE Name: 2,2-dimethoxy-3-methyl-butane
IUPAC Name: 2,2-dimethoxy-3-methylbutane
SYSTEMATIC NAME: 2,2-dimethoxy-3-methyl-butane
MOLECULAR FORMULA: C7H16O2
MOLECULAR WEIGHT: 132.20074
SMILES: CC(C)C(C)(OC)OC
Structure:
CAS RN: 59528-29-9
CAS Name: (4-butoxyphenyl)methanamine hydrochloride
OPENEYE Name: (4-butoxyphenyl)methanamine hydrochloride
IUPAC Name: (4-butoxyphenyl)methanamine hydrochloride
SYSTEMATIC NAME: (4-butoxyphenyl)methanamine hydrochloride
MOLECULAR FORMULA: C11H18ClNO
MOLECULAR WEIGHT: 215.71972
SMILES: CCCCOC1=CC=C(C=C1)CN.Cl
Structure:
CAS RN: 59507-56-1
CAS Name: 1,2-bis(methylthio)ethyne
OPENEYE Name: 1,2-bis(methylsulfanyl)acetylene
IUPAC Name: 1,2-bis(methylsulfanyl)ethyne
SYSTEMATIC NAME: 1,2-bis(methylsulfanyl)ethyne
MOLECULAR FORMULA: C4H6S2
MOLECULAR WEIGHT: 118.22044
SMILES: CSC#CSC
Structure:
CAS RN: 59434-05-8
CAS Name: 2,5-dinitrothiophene
OPENEYE Name: 2,5-dinitrothiophene
IUPAC Name: 2,5-dinitrothiophene
SYSTEMATIC NAME: 2,5-dinitrothiophene
MOLECULAR FORMULA: C4H2N2O4S
MOLECULAR WEIGHT: 174.13468
SMILES: C1=C(SC(=C1)[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 59388-64-6
CAS Name: bis(4-bicyclo[2.2.1]heptanyl)diazene
OPENEYE Name: di(norbornan-1-yl)diazene
IUPAC Name: bis(4-bicyclo[2.2.1]heptanyl)diazene
SYSTEMATIC NAME: bis(4-bicyclo[2.2.1]heptanyl)diazene
MOLECULAR FORMULA: C14H22N2
MOLECULAR WEIGHT: 218.33788
SMILES: C1CC2(CCC1C2)N=NC34CCC(C3)CC4
Structure:
CAS RN: 59388-65-7
CAS Name: bis(4-bicyclo[2.2.1]heptanyl)diazene
OPENEYE Name: di(norbornan-1-yl)diazene
IUPAC Name: bis(4-bicyclo[2.2.1]heptanyl)diazene
SYSTEMATIC NAME: bis(4-bicyclo[2.2.1]heptanyl)diazene
MOLECULAR FORMULA: C14H22N2
MOLECULAR WEIGHT: 218.33788
SMILES: C1CC2(CCC1C2)N=NC34CCC(C3)CC4
Structure:
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