AC44266
77640-03-0 | 3-(1-Methyl-1h-pyrrol-2-yl)-3-oxopropanenitrile
Manufacturer: A2B Chem
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CatalogNumber
AC44266
ChemicalName
3-(1-Methyl-1h-pyrrol-2-yl)-3-oxopropanenitrile
CasNumber
77640-03-0
MolecularFormula
C8H8N2O
MolecularWeight
148.1619
MdlNumber
MFCD01569984
Smiles
N#CCC(=O)c1cccn1C
Complexity
203
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
2
RotatableBondCount
2
Xlogp3
0.6
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CatalogNumber: AC44266
ChemicalName: 3-(1-Methyl-1h-pyrrol-2-yl)-3-oxopropanenitrile
CasNumber: 77640-03-0
MolecularFormula: C8H8N2O
MolecularWeight: 148.1619
MdlNumber: MFCD01569984
Smiles: N#CCC(=O)c1cccn1C
Complexity: 203
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
Xlogp3: 0.6
CatalogNumber:
AC44266
ChemicalName:
3-(1-Methyl-1h-pyrrol-2-yl)-3-oxopropanenitrile
CasNumber:
77640-03-0
MolecularFormula:
C8H8N2O
MolecularWeight:
148.1619
MdlNumber:
MFCD01569984
Smiles:
N#CCC(=O)c1cccn1C
Complexity:
203
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
Xlogp3:
0.6
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Smiles: CCOc1c(F)c(F)c(c(c1F)F)F
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Xlogp3: __
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Smiles:
CCOc1c(F)c(F)c(c(c1F)F)F
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Smiles: CCCCCCCCCCCCc1ccc(c(c1)C=NO)O
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Smiles:
CCCCCCCCCCCCc1ccc(c(c1)C=NO)O
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__
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Smiles: Cc1ccc(cc1)/C(=C/C(=O)c1ccc(cc1)C)/O
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Smiles:
Cc1ccc(cc1)/C(=C/C(=O)c1ccc(cc1)C)/O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
__