AB82718
893640-23-8 | 4-(3-Cyanophenyl)phenylacetic acid
Manufacturer: A2B Chem
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CatalogNumber
AB82718
ChemicalName
4-(3-Cyanophenyl)phenylacetic acid
CasNumber
893640-23-8
MolecularFormula
C15H11NO2
MolecularWeight
237.2533
MdlNumber
MFCD05980727
Smiles
N#Cc1cccc(c1)c1ccc(cc1)CC(=O)O
Complexity
336
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
2.8
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CatalogNumber: AB82718
ChemicalName: 4-(3-Cyanophenyl)phenylacetic acid
CasNumber: 893640-23-8
MolecularFormula: C15H11NO2
MolecularWeight: 237.2533
MdlNumber: MFCD05980727
Smiles: N#Cc1cccc(c1)c1ccc(cc1)CC(=O)O
Complexity: 336
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2.8
CatalogNumber:
AB82718
ChemicalName:
4-(3-Cyanophenyl)phenylacetic acid
CasNumber:
893640-23-8
MolecularFormula:
C15H11NO2
MolecularWeight:
237.2533
MdlNumber:
MFCD05980727
Smiles:
N#Cc1cccc(c1)c1ccc(cc1)CC(=O)O
Complexity:
336
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2.8
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Smiles: NCc1noc(c1)CC(C)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
NCc1noc(c1)CC(C)C
Complexity:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: COc1ccc(c(c1)Sc1ccccc1)OC
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Xlogp3: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
COc1ccc(c(c1)Sc1ccccc1)OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: N#Cc1cc([N+](=O)[O-])c(cc1F)Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N#Cc1cc([N+](=O)[O-])c(cc1F)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__