AD51975
27916-43-4 | 3-(2-Cyanophenyl)propanoic acid
Manufacturer: A2B Chem
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CatalogNumber
AD51975
ChemicalName
3-(2-Cyanophenyl)propanoic acid
CasNumber
27916-43-4
MolecularFormula
C10H9NO2
MolecularWeight
175.184
MdlNumber
MFCD00464857
Smiles
N#Cc1ccccc1CCC(=O)O
Complexity
228
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
1.4
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CatalogNumber: AD51975
ChemicalName: 3-(2-Cyanophenyl)propanoic acid
CasNumber: 27916-43-4
MolecularFormula: C10H9NO2
MolecularWeight: 175.184
MdlNumber: MFCD00464857
Smiles: N#Cc1ccccc1CCC(=O)O
Complexity: 228
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1.4
CatalogNumber:
AD51975
ChemicalName:
3-(2-Cyanophenyl)propanoic acid
CasNumber:
27916-43-4
MolecularFormula:
C10H9NO2
MolecularWeight:
175.184
MdlNumber:
MFCD00464857
Smiles:
N#Cc1ccccc1CCC(=O)O
Complexity:
228
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: N#CCCN(c1ccc(cc1)C=O)CC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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MolecularFormula:
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MolecularWeight:
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Smiles:
N#CCCN(c1ccc(cc1)C=O)CC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
__
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ChemicalName: __
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MolecularFormula: __
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Smiles: CCCCCCCCCCCCCCCC(OC)OC
Complexity: __
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Smiles:
CCCCCCCCCCCCCCCC(OC)OC
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
__
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Smiles: [O-]C(=O)C(CC(=O)[O-])(CC(=O)[O-])O.[Ga+3]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-]C(=O)C(CC(=O)[O-])(CC(=O)[O-])O.[Ga+3]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__