AF29047
28166-41-8 | Alpha-cyano-4-hydroxycinnamic acid
Manufacturer: A2B Chem
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CatalogNumber
AF29047
ChemicalName
Alpha-cyano-4-hydroxycinnamic acid
CasNumber
28166-41-8
MolecularFormula
C10H7NO3
MolecularWeight
189.16747999999998
MdlNumber
MFCD00004204
Smiles
N#CC(=Cc1ccc(cc1)O)C(=O)O
Complexity
292
Covalently-bondedUnitCount
1
DefinedBondStereocenterCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
2
Xlogp3
1.4
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CatalogNumber: AF29047
ChemicalName: Alpha-cyano-4-hydroxycinnamic acid
CasNumber: 28166-41-8
MolecularFormula: C10H7NO3
MolecularWeight: 189.16747999999998
MdlNumber: MFCD00004204
Smiles: N#CC(=Cc1ccc(cc1)O)C(=O)O
Complexity: 292
Covalently-bondedUnitCount: 1
DefinedBondStereocenterCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 1.4
CatalogNumber:
AF29047
ChemicalName:
Alpha-cyano-4-hydroxycinnamic acid
CasNumber:
28166-41-8
MolecularFormula:
C10H7NO3
MolecularWeight:
189.16747999999998
MdlNumber:
MFCD00004204
Smiles:
N#CC(=Cc1ccc(cc1)O)C(=O)O
Complexity:
292
Covalently-bondedUnitCount:
1
DefinedBondStereocenterCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
1.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: c1ccc(cc1)[As+](c1ccccc1)(c1ccccc1)c1ccccc1.[Cl-].Cl.O.O
Complexity: __
Covalently-bondedUnitCount: __
DefinedBondStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
c1ccc(cc1)[As+](c1ccccc1)(c1ccccc1)c1ccccc1.[Cl-].Cl.O.O
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedBondStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: __
Complexity: __
Covalently-bondedUnitCount: __
DefinedBondStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
__
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedBondStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AF29050
ChemicalName: 1-Phenylcyclohexanecarbonitrile
CasNumber: 2201-23-2
MolecularFormula: C13H15N
MolecularWeight: 185.2649
MdlNumber: MFCD00021281
Smiles: N#CC1(CCCCC1)c1ccccc1
Complexity: 223
Covalently-bondedUnitCount: 1
DefinedBondStereocenterCount: __
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 3.5
CatalogNumber:
AF29050
ChemicalName:
1-Phenylcyclohexanecarbonitrile
CasNumber:
2201-23-2
MolecularFormula:
C13H15N
MolecularWeight:
185.2649
MdlNumber:
MFCD00021281
Smiles:
N#CC1(CCCCC1)c1ccccc1
Complexity:
223
Covalently-bondedUnitCount:
1
DefinedBondStereocenterCount:
__
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
3.5