CAS RN: 6794-96-3
CAS Name: 6-methyl-1,5-diazabicyclo[3.1.0]hexane
OPENEYE Name: 6-methyl-1,5-diazabicyclo[3.1.0]hexane
IUPAC Name: 6-methyl-1,5-diazabicyclo[3.1.0]hexane
SYSTEMATIC NAME: 6-methyl-1,5-diazabicyclo[3.1.0]hexane
MOLECULAR FORMULA: C5H10N2
MOLECULAR WEIGHT: 98.1463
SMILES: CC1N2N1CCC2
Structure:
CAS RN: 6794-95-2
CAS Name: 1,2-dimethyldiaziridine
OPENEYE Name: 1,2-dimethyldiaziridine
IUPAC Name: 1,2-dimethyldiaziridine
SYSTEMATIC NAME: 1,2-dimethyl-1,2-diaziridine
MOLECULAR FORMULA: C3H8N2
MOLECULAR WEIGHT: 72.10902
SMILES: CN1CN1C
Structure:
CAS RN: 6793-92-6
CAS Name: 1-bromo-4-phenylmethoxybenzene
OPENEYE Name: 1-benzyloxy-4-bromo-benzene
IUPAC Name: 1-bromo-4-phenylmethoxybenzene
SYSTEMATIC NAME: 1-bromanyl-4-phenylmethoxy-benzene
MOLECULAR FORMULA: C13H11BrO
MOLECULAR WEIGHT: 263.12984
SMILES: C1=CC=C(C=C1)COC2=CC=C(C=C2)Br
Structure:
CAS RN: 6790-27-8
CAS Name: 3-dodecyne
OPENEYE Name: dodec-3-yne
IUPAC Name: dodec-3-yne
SYSTEMATIC NAME: dodec-3-yne
MOLECULAR FORMULA: C12H22
MOLECULAR WEIGHT: 166.30308
SMILES: CCCCCCCCC#CCC
Structure:
CAS RN: 6789-51-1
CAS Name: 2-methylpyrrolo[3,4-c]pyridine-1,3-dione
OPENEYE Name: 2-methylpyrrolo[3,4-c]pyridine-1,3-dione
IUPAC Name: 2-methylpyrrolo[3,4-c]pyridine-1,3-dione
SYSTEMATIC NAME: 2-methylpyrrolo[3,4-c]pyridine-1,3-dione
MOLECULAR FORMULA: C8H6N2O2
MOLECULAR WEIGHT: 162.14544
SMILES: CN1C(=O)C2=C(C1=O)C=NC=C2
Structure:
CAS RN: 6789-38-4
CAS Name: 9-azabicyclo[4.2.1]nona-2,4,7-triene
OPENEYE Name: 9-azabicyclo[4.2.1]nona-2,4,7-triene
IUPAC Name: 9-azabicyclo[4.2.1]nona-2,4,7-triene
SYSTEMATIC NAME: 9-azabicyclo[4.2.1]nona-2,4,7-triene
MOLECULAR FORMULA: C8H9N
MOLECULAR WEIGHT: 119.16376
SMILES: C1=CC2C=CC(N2)C=C1
Structure:
CAS RN: 6788-85-8
CAS Name: 2,3-dihydroazete
OPENEYE Name: 2,3-dihydroazete
IUPAC Name: 2,3-dihydroazete
SYSTEMATIC NAME: 2,3-dihydroazete
MOLECULAR FORMULA: C3H5N
MOLECULAR WEIGHT: 55.0785
SMILES: C1CN=C1
Structure:
CAS RN: 6785-23-5
CAS Name: undecylcyclopentane
OPENEYE Name: undecylcyclopentane
IUPAC Name: undecylcyclopentane
SYSTEMATIC NAME: undecylcyclopentane
MOLECULAR FORMULA: C16H32
MOLECULAR WEIGHT: 224.42528
SMILES: CCCCCCCCCCCC1CCCC1
Structure:
CAS RN: 6784-47-0
CAS Name: 2-(1,3-dithiolan-2-yl)-1,3-dithiolane
OPENEYE Name: 2-(1,3-dithiolan-2-yl)-1,3-dithiolane
IUPAC Name: 2-(1,3-dithiolan-2-yl)-1,3-dithiolane
SYSTEMATIC NAME: 2-(1,3-dithiolan-2-yl)-1,3-dithiolane
MOLECULAR FORMULA: C6H10S4
MOLECULAR WEIGHT: 210.4036
SMILES: C1CSC(S1)C2SCCS2
Structure:
CAS RN: 6775-78-6
CAS Name: 6-chloroimidazo[1,2-b]pyridazine
OPENEYE Name: 6-chloroimidazo[1,2-b]pyridazine
IUPAC Name: 6-chloroimidazo[1,2-b]pyridazine
SYSTEMATIC NAME: 6-chloranylimidazo[1,2-b]pyridazine
MOLECULAR FORMULA: C6H4ClN3
MOLECULAR WEIGHT: 153.56906
SMILES: C1=CC(=NN2C1=NC=C2)Cl
Structure:
CAS RN: 6775-01-5
CAS Name: 3-[3-aminopropyl(phenyl)phosphino]-1-propanamine
OPENEYE Name: 3-[3-aminopropyl(phenyl)phosphanyl]propan-1-amine
IUPAC Name: 3-[3-aminopropyl(phenyl)phosphanyl]propan-1-amine
SYSTEMATIC NAME: 3-[3-azanylpropyl(phenyl)phosphanyl]propan-1-amine
MOLECULAR FORMULA: C12H21N2P
MOLECULAR WEIGHT: 224.282301
SMILES: C1=CC=C(C=C1)P(CCCN)CCCN
Structure:
CAS RN: 76293-41-9
CAS Name: 2-[2-(2-iodophenyl)ethenyl]pyridine
OPENEYE Name: 2-[2-(2-iodophenyl)vinyl]pyridine
IUPAC Name: 2-[2-(2-iodophenyl)ethenyl]pyridine
SYSTEMATIC NAME: 2-[2-(2-iodanylphenyl)ethenyl]pyridine
MOLECULAR FORMULA: C13H10IN
MOLECULAR WEIGHT: 307.12967
SMILES: C1=CC=C(C(=C1)C=CC2=CC=CC=N2)I
Structure:
CAS RN: 6755-54-0
CAS Name: 1,1-dideuterioethene
OPENEYE Name: 1,1-dideuterioethylene
IUPAC Name: 1,1-dideuterioethene
SYSTEMATIC NAME: 1,1-dideuterioethene
MOLECULAR FORMULA: C2H4
MOLECULAR WEIGHT: 30.065484
SMILES: [2H]C(=C)[2H]
Structure:
CAS RN: 6746-94-7
CAS Name: ethynylcyclopropane
OPENEYE Name: ethynylcyclopropane
IUPAC Name: ethynylcyclopropane
SYSTEMATIC NAME: ethynylcyclopropane
MOLECULAR FORMULA: C5H6
MOLECULAR WEIGHT: 66.10114
SMILES: C#CC1CC1
Structure:
CAS RN: 6745-35-3
CAS Name: 1-chloro-1,2,2-trideuterioethene
OPENEYE Name: 1-chloro-1,2,2-trideuterio-ethylene
IUPAC Name: 1-chloro-1,2,2-trideuterioethene
SYSTEMATIC NAME: 1-chloranyl-1,2,2-trideuterio-ethene
MOLECULAR FORMULA: C2H3Cl
MOLECULAR WEIGHT: 65.516705
SMILES: [2H]C(=C([2H])Cl)[2H]
Structure:
CAS RN: 6737-11-7
CAS Name: acetic acid but-3-en-2-yl ester
OPENEYE Name: 1-methylallyl acetate
IUPAC Name: but-3-en-2-yl acetate
SYSTEMATIC NAME: but-3-en-2-yl ethanoate
MOLECULAR FORMULA: C6H10O2
MOLECULAR WEIGHT: 114.1424
SMILES: CC(C=C)OC(=O)C
Structure:
CAS RN: 6733-01-3
CAS Name: 1,2,3,4,5,6-hexafluorobicyclo[2.2.0]hexa-2,5-diene
OPENEYE Name: 1,2,3,4,5,6-hexafluorobicyclo[2.2.0]hexa-2,5-diene
IUPAC Name: 1,2,3,4,5,6-hexafluorobicyclo[2.2.0]hexa-2,5-diene
SYSTEMATIC NAME: 1,2,3,4,5,6-hexakis(fluoranyl)bicyclo[2.2.0]hexa-2,5-diene
MOLECULAR FORMULA: C6F6
MOLECULAR WEIGHT: 186.054619
SMILES: C1(=C(C2(C1(C(=C2F)F)F)F)F)F
Structure:
CAS RN: 6725-64-0
CAS Name: methanedithiol
OPENEYE Name: methanedithiol
IUPAC Name: methanedithiol
SYSTEMATIC NAME: methanedithiol
MOLECULAR FORMULA: CH4S2
MOLECULAR WEIGHT: 80.17246
SMILES: C(S)S
Structure:
CAS RN: 6720-37-2
CAS Name: 3-(3-nitrophenyl)-2-phenyl-2-propenenitrile
OPENEYE Name: 3-(3-nitrophenyl)-2-phenyl-prop-2-enenitrile
IUPAC Name: 3-(3-nitrophenyl)-2-phenylprop-2-enenitrile
SYSTEMATIC NAME: 3-(3-nitrophenyl)-2-phenyl-prop-2-enenitrile
MOLECULAR FORMULA: C15H10N2O2
MOLECULAR WEIGHT: 250.2521
SMILES: C1=CC=C(C=C1)C(=CC2=CC(=CC=C2)[N+](=O)[O-])C#N
Structure:
CAS RN: 6711-19-9
CAS Name: methanidylbenzene
OPENEYE Name: methanidylbenzene
IUPAC Name: methanidylbenzene
SYSTEMATIC NAME: methanidylbenzene
MOLECULAR FORMULA: C7H7-
MOLECULAR WEIGHT: 91.13048
SMILES: [CH2-]C1=CC=CC=C1
Structure:
CAS RN: 6706-53-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C11H14
MOLECULAR WEIGHT: 146.22886
SMILES: C1CC23CCC2(C1)C=CC=C3
Structure:
CAS RN: 6705-50-6
CAS Name: 7-oxabicyclo[2.2.1]hept-2-ene
OPENEYE Name: 7-oxabicyclo[2.2.1]hept-2-ene
IUPAC Name: 7-oxabicyclo[2.2.1]hept-2-ene
SYSTEMATIC NAME: 7-oxabicyclo[2.2.1]hept-2-ene
MOLECULAR FORMULA: C6H8O
MOLECULAR WEIGHT: 96.12712
SMILES: C1CC2C=CC1O2
Structure:
CAS RN: 6703-99-7
CAS Name: heneicosan-11-ylcyclohexane
OPENEYE Name: 1-decylundecylcyclohexane
IUPAC Name: henicosan-11-ylcyclohexane
SYSTEMATIC NAME: henicosan-11-ylcyclohexane
MOLECULAR FORMULA: C27H54
MOLECULAR WEIGHT: 378.71766
SMILES: CCCCCCCCCCC(CCCCCCCCCC)C1CCCCC1
Structure:
CAS RN: 6697-15-0
CAS Name: pentacosan-13-ylcyclohexane
OPENEYE Name: 1-dodecyltridecylcyclohexane
IUPAC Name: pentacosan-13-ylcyclohexane
SYSTEMATIC NAME: pentacosan-13-ylcyclohexane
MOLECULAR FORMULA: C31H62
MOLECULAR WEIGHT: 434.82398
SMILES: CCCCCCCCCCCCC(CCCCCCCCCCCC)C1CCCCC1
Structure:
CAS RN: 19245-72-8
CAS Name: 5-bicyclo[2.2.2]oct-2-enol
OPENEYE Name: bicyclo[2.2.2]oct-2-en-5-ol
IUPAC Name: bicyclo[2.2.2]oct-2-en-5-ol
SYSTEMATIC NAME: bicyclo[2.2.2]oct-2-en-5-ol
MOLECULAR FORMULA: C8H12O
MOLECULAR WEIGHT: 124.18028
SMILES: C1CC2C=CC1CC2O
Structure:
CAS RN: 55320-40-6
CAS Name: 5-bicyclo[2.2.2]oct-2-enol
OPENEYE Name: bicyclo[2.2.2]oct-2-en-5-ol
IUPAC Name: bicyclo[2.2.2]oct-2-en-5-ol
SYSTEMATIC NAME: bicyclo[2.2.2]oct-2-en-5-ol
MOLECULAR FORMULA: C8H12O
MOLECULAR WEIGHT: 124.18028
SMILES: C1CC2C=CC1CC2O
Structure:
CAS RN: 6688-07-9
CAS Name: 5-bicyclo[2.2.2]oct-2-enol
OPENEYE Name: bicyclo[2.2.2]oct-2-en-5-ol
IUPAC Name: bicyclo[2.2.2]oct-2-en-5-ol
SYSTEMATIC NAME: bicyclo[2.2.2]oct-2-en-5-ol
MOLECULAR FORMULA: C8H12O
MOLECULAR WEIGHT: 124.18028
SMILES: C1CC2C=CC1CC2O
Structure:
CAS RN: 6683-51-8
CAS Name: 3-methylbut-3-enylbenzene
OPENEYE Name: 3-methylbut-3-enylbenzene
IUPAC Name: 3-methylbut-3-enylbenzene
SYSTEMATIC NAME: 3-methylbut-3-enylbenzene
MOLECULAR FORMULA: C11H14
MOLECULAR WEIGHT: 146.22886
SMILES: CC(=C)CCC1=CC=CC=C1
Structure:
CAS RN: 6682-67-3
CAS Name: 3,3,4,5,7-pentamethyl-1,2-dihydroindene
OPENEYE Name: 1,1,4,6,7-pentamethylindane
IUPAC Name: 3,3,4,5,7-pentamethyl-1,2-dihydroindene
SYSTEMATIC NAME: 3,3,4,5,7-pentamethyl-1,2-dihydroindene
MOLECULAR FORMULA: C14H20
MOLECULAR WEIGHT: 188.3086
SMILES: CC1=CC(=C(C2=C1CCC2(C)C)C)C
Structure:
CAS RN: 6675-72-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C10H12
MOLECULAR WEIGHT: 132.20228
SMILES: C1CC2CC1C3=CCC=C23
Structure:
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