CAS RN: 39546-80-0
CAS Name: 2,2-dimethylpropylidenecyclohexane
OPENEYE Name: 2,2-dimethylpropylidenecyclohexane
IUPAC Name: 2,2-dimethylpropylidenecyclohexane
SYSTEMATIC NAME: 2,2-dimethylpropylidenecyclohexane
MOLECULAR FORMULA: C11H20
MOLECULAR WEIGHT: 152.2765
SMILES: CC(C)(C)C=C1CCCCC1
Structure:
CAS RN: 39432-21-8
CAS Name: europium; vanadium; trihydrate
OPENEYE Name: europium; vanadium; trihydrate
IUPAC Name: europium; vanadium; trihydrate
SYSTEMATIC NAME: europium; vanadium; trihydrate
MOLECULAR FORMULA: EuH6O3V
MOLECULAR WEIGHT: 256.95134
SMILES: O.O.O.[V].[Eu]
Structure:
CAS RN: 39327-80-5
CAS Name: trioxorhenium hydroiodide
OPENEYE Name: trioxorhenium hydroiodide
IUPAC Name: trioxorhenium hydroiodide
SYSTEMATIC NAME: tris(oxidanylidene)rhenium hydroiodide
MOLECULAR FORMULA: HIO3Re
MOLECULAR WEIGHT: 362.11761
SMILES: O=[Re](=O)=O.I
Structure:
CAS RN: 39247-66-0
CAS Name: 1,4-dimethyl-2,3-dihydrotetrazine
OPENEYE Name: 1,4-dimethyl-2,3-dihydrotetrazine
IUPAC Name: 1,4-dimethyl-2,3-dihydrotetrazine
SYSTEMATIC NAME: 1,4-dimethyl-2,3-dihydro-1,2,3,4-tetrazine
MOLECULAR FORMULA: C4H10N4
MOLECULAR WEIGHT: 114.149
SMILES: CN1C=CN(NN1)C
Structure:
CAS RN: 39239-96-8
CAS Name: 2-(2-methyl-1,3-dioxan-2-yl)-2-propanol
OPENEYE Name: 2-(2-methyl-1,3-dioxan-2-yl)propan-2-ol
IUPAC Name: 2-(2-methyl-1,3-dioxan-2-yl)propan-2-ol
SYSTEMATIC NAME: 2-(2-methyl-1,3-dioxan-2-yl)propan-2-ol
MOLECULAR FORMULA: C8H16O3
MOLECULAR WEIGHT: 160.21084
SMILES: CC1(OCCCO1)C(C)(C)O
Structure:
CAS RN: 39239-93-5
CAS Name: 1,3-dioxan-2-ylmethanol
OPENEYE Name: 1,3-dioxan-2-ylmethanol
IUPAC Name: 1,3-dioxan-2-ylmethanol
SYSTEMATIC NAME: 1,3-dioxan-2-ylmethanol
MOLECULAR FORMULA: C5H10O3
MOLECULAR WEIGHT: 118.1311
SMILES: C1COC(OC1)CO
Structure:
CAS RN: 39232-03-6
CAS Name: 4-(2-bromoethyl)aniline
OPENEYE Name: 4-(2-bromoethyl)aniline
IUPAC Name: 4-(2-bromoethyl)aniline
SYSTEMATIC NAME: 4-(2-bromoethyl)aniline
MOLECULAR FORMULA: C8H10BrN
MOLECULAR WEIGHT: 200.0757
SMILES: C1=CC(=CC=C1CCBr)N
Structure:
CAS RN: 39198-81-7
CAS Name: 1-(2-methylpropyl)pyrrolidine
OPENEYE Name: 1-isobutylpyrrolidine
IUPAC Name: 1-(2-methylpropyl)pyrrolidine
SYSTEMATIC NAME: 1-(2-methylpropyl)pyrrolidine
MOLECULAR FORMULA: C8H17N
MOLECULAR WEIGHT: 127.22728
SMILES: CC(C)CN1CCCC1
Structure:
CAS RN: 39198-34-0
CAS Name: bis(2,4,4-trimethylpentan-2-yl)diazene
OPENEYE Name: bis(1,1,3,3-tetramethylbutyl)diazene
IUPAC Name: bis(2,4,4-trimethylpentan-2-yl)diazene
SYSTEMATIC NAME: bis(2,4,4-trimethylpentan-2-yl)diazene
MOLECULAR FORMULA: C16H34N2
MOLECULAR WEIGHT: 254.45456
SMILES: CC(C)(C)CC(C)(C)N=NC(C)(C)CC(C)(C)C
Structure:
CAS RN: 39187-47-8
CAS Name: 2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]propanoic acid methyl ester
OPENEYE Name: methyl 2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]propanoate
IUPAC Name: methyl 2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]propanoate
SYSTEMATIC NAME: methyl 2,3,3,3-tetrakis(fluoranyl)-2-[1,1,2,3,3,3-hexakis(fluoranyl)-2-[1,1,2,3,3,3-hexakis(fluoranyl)-2-[1,1,2,2,3,3,3-heptakis(fluoranyl)propoxy]propoxy]propoxy]propanoate
MOLECULAR FORMULA: C13H3F23O5
MOLECULAR WEIGHT: 676.123194
SMILES: COC(=O)C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)(F)F)F)(F)F)F
Structure:
CAS RN: 39161-60-9
CAS Name: 1,6-dimethyl-2,3,4,5-tetrahydro-1,6-benzodiazocine
OPENEYE Name: 1,6-dimethyl-2,3,4,5-tetrahydro-1,6-benzodiazocine
IUPAC Name: 1,6-dimethyl-2,3,4,5-tetrahydro-1,6-benzodiazocine
SYSTEMATIC NAME: 1,6-dimethyl-2,3,4,5-tetrahydro-1,6-benzodiazocine
MOLECULAR FORMULA: C12H18N2
MOLECULAR WEIGHT: 190.28472
SMILES: CN1CCCCN(C2=CC=CC=C21)C
Structure:
CAS RN: 39153-73-6
CAS Name: 2-chloro-1,3,4-trifluorobenzene
OPENEYE Name: 2-chloro-1,3,4-trifluoro-benzene
IUPAC Name: 2-chloro-1,3,4-trifluorobenzene
SYSTEMATIC NAME: 2-chloranyl-1,3,4-tris(fluoranyl)benzene
MOLECULAR FORMULA: C6H2ClF3
MOLECULAR WEIGHT: 166.52829
SMILES: C1=CC(=C(C(=C1F)F)Cl)F
Structure:
CAS RN: 39130-85-3
CAS Name: 3,3,3-trifluoro-1-iodo-1-propyne
OPENEYE Name: 3,3,3-trifluoro-1-iodo-prop-1-yne
IUPAC Name: 3,3,3-trifluoro-1-iodoprop-1-yne
SYSTEMATIC NAME: 3,3,3-tris(fluoranyl)-1-iodanyl-prop-1-yne
MOLECULAR FORMULA: C3F3I
MOLECULAR WEIGHT: 219.93178
SMILES: C(#CI)C(F)(F)F
Structure:
CAS RN: 39087-21-3
CAS Name: 5-butyl-2-methyl-1,3-dioxane
OPENEYE Name: 5-butyl-2-methyl-1,3-dioxane
IUPAC Name: 5-butyl-2-methyl-1,3-dioxane
SYSTEMATIC NAME: 5-butyl-2-methyl-1,3-dioxane
MOLECULAR FORMULA: C9H18O2
MOLECULAR WEIGHT: 158.23802
SMILES: CCCCC1COC(OC1)C
Structure:
CAS RN: 39087-22-4
CAS Name: 5-butyl-2-methyl-1,3-dioxane
OPENEYE Name: 5-butyl-2-methyl-1,3-dioxane
IUPAC Name: 5-butyl-2-methyl-1,3-dioxane
SYSTEMATIC NAME: 5-butyl-2-methyl-1,3-dioxane
MOLECULAR FORMULA: C9H18O2
MOLECULAR WEIGHT: 158.23802
SMILES: CCCCC1COC(OC1)C
Structure:
CAS RN: 39066-37-0
CAS Name: 4-thiabicyclo[3.2.1]octa-2,6-diene
OPENEYE Name: 4-thiabicyclo[3.2.1]octa-2,6-diene
IUPAC Name: 4-thiabicyclo[3.2.1]octa-2,6-diene
SYSTEMATIC NAME: 4-thiabicyclo[3.2.1]octa-2,6-diene
MOLECULAR FORMULA: C7H8S
MOLECULAR WEIGHT: 124.20342
SMILES: C1C2C=CC1SC=C2
Structure:
CAS RN: 39060-95-2
CAS Name: 2-(2,3-dihydro-1H-inden-2-yl)-2,3-dihydro-1H-indene
OPENEYE Name: 2-indan-2-ylindane
IUPAC Name: 2-(2,3-dihydro-1H-inden-2-yl)-2,3-dihydro-1H-indene
SYSTEMATIC NAME: 2-(2,3-dihydro-1H-inden-2-yl)-2,3-dihydro-1H-indene
MOLECULAR FORMULA: C18H18
MOLECULAR WEIGHT: 234.33552
SMILES: C1C(CC2=CC=CC=C21)C3CC4=CC=CC=C4C3
Structure:
CAS RN: 39054-97-2
CAS Name: 1,3-dihydrophenalen-2-one
OPENEYE Name: 1,3-dihydrophenalen-2-one
IUPAC Name: 1,3-dihydrophenalen-2-one
SYSTEMATIC NAME: 1,3-dihydrophenalen-2-one
MOLECULAR FORMULA: C13H10O
MOLECULAR WEIGHT: 182.2179
SMILES: C1C(=O)CC2=CC=CC3=C2C1=CC=C3
Structure:
CAS RN: 38992-78-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C12H18
MOLECULAR WEIGHT: 162.27132
SMILES: C1CCC23CCCCC2(C1)C=C3
Structure:
CAS RN: 38951-83-6
CAS Name: 1-chloro-2,2,6,6-tetramethyl-4-piperidinone
OPENEYE Name: 1-chloro-2,2,6,6-tetramethyl-piperidin-4-one
IUPAC Name: 1-chloro-2,2,6,6-tetramethylpiperidin-4-one
SYSTEMATIC NAME: 1-chloranyl-2,2,6,6-tetramethyl-piperidin-4-one
MOLECULAR FORMULA: C9H16ClNO
MOLECULAR WEIGHT: 189.68244
SMILES: CC1(CC(=O)CC(N1Cl)(C)C)C
Structure:
CAS RN: 38951-66-5
CAS Name: 1-methyl-3,3-di(propan-2-yl)azetidine-2,4-dione
OPENEYE Name: 3,3-diisopropyl-1-methyl-azetidine-2,4-dione
IUPAC Name: 1-methyl-3,3-di(propan-2-yl)azetidine-2,4-dione
SYSTEMATIC NAME: 1-methyl-3,3-di(propan-2-yl)azetidine-2,4-dione
MOLECULAR FORMULA: C10H17NO2
MOLECULAR WEIGHT: 183.24748
SMILES: CC(C)C1(C(=O)N(C1=O)C)C(C)C
Structure:
CAS RN: 38924-53-7
CAS Name: (4-amino-1,2,5-oxadiazol-3-yl)-phenylmethanone
OPENEYE Name: (4-amino-1,2,5-oxadiazol-3-yl)-phenyl-methanone
IUPAC Name: (4-amino-1,2,5-oxadiazol-3-yl)-phenylmethanone
SYSTEMATIC NAME: (4-azanyl-1,2,5-oxadiazol-3-yl)-phenyl-methanone
MOLECULAR FORMULA: C9H7N3O2
MOLECULAR WEIGHT: 189.17078
SMILES: C1=CC=C(C=C1)C(=O)C2=NON=C2N
Structure:
CAS RN: 38898-42-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C8H8
MOLECULAR WEIGHT: 104.14912
SMILES: C=C1C2C3C2C4C3C41
Structure:
CAS RN: 38898-39-4
CAS Name: 9-methylenebicyclo[4.2.1]nona-2,4,7-triene
OPENEYE Name: 9-methylenebicyclo[4.2.1]nona-2,4,7-triene
IUPAC Name: 9-methylidenebicyclo[4.2.1]nona-2,4,7-triene
SYSTEMATIC NAME: 9-methylidenebicyclo[4.2.1]nona-2,4,7-triene
MOLECULAR FORMULA: C10H10
MOLECULAR WEIGHT: 130.1864
SMILES: C=C1C2C=CC=CC1C=C2
Structure:
CAS RN: 38880-06-7
CAS Name: 2,2-dimethylpropyl(methyl)mercury
OPENEYE Name: 2,2-dimethylpropyl(methyl)mercury
IUPAC Name: 2,2-dimethylpropyl(methyl)mercury
SYSTEMATIC NAME: 2,2-dimethylpropyl(methyl)mercury
MOLECULAR FORMULA: C6H14Hg
MOLECULAR WEIGHT: 286.76536
SMILES: CC(C)(C)C[Hg]C
Structure:
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