AB63247
42287-94-5 | 3-(4-Cyanophenyl)propanoic acid
Manufacturer: A2B Chem
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CatalogNumber
AB63247
ChemicalName
3-(4-Cyanophenyl)propanoic acid
CasNumber
42287-94-5
MolecularFormula
C10H9NO2
MolecularWeight
175.184
MdlNumber
MFCD08234823
Smiles
N#Cc1ccc(cc1)CCC(=O)O
Complexity
220
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
1.2
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CatalogNumber: AB63247
ChemicalName: 3-(4-Cyanophenyl)propanoic acid
CasNumber: 42287-94-5
MolecularFormula: C10H9NO2
MolecularWeight: 175.184
MdlNumber: MFCD08234823
Smiles: N#Cc1ccc(cc1)CCC(=O)O
Complexity: 220
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1.2
CatalogNumber:
AB63247
ChemicalName:
3-(4-Cyanophenyl)propanoic acid
CasNumber:
42287-94-5
MolecularFormula:
C10H9NO2
MolecularWeight:
175.184
MdlNumber:
MFCD08234823
Smiles:
N#Cc1ccc(cc1)CCC(=O)O
Complexity:
220
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOc1ccc(cc1)C(=O)CCC(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOc1ccc(cc1)C(=O)CCC(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB63249
ChemicalName: 3-(4-Ethoxyphenyl)propanoic acid
CasNumber: 4919-34-0
MolecularFormula: C11H14O3
MolecularWeight: 194.2271
MdlNumber: MFCD00016557
Smiles: CCOc1ccc(cc1)CCC(=O)O
Complexity: 171
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 5
Xlogp3: 2.3
CatalogNumber:
AB63249
ChemicalName:
3-(4-Ethoxyphenyl)propanoic acid
CasNumber:
4919-34-0
MolecularFormula:
C11H14O3
MolecularWeight:
194.2271
MdlNumber:
MFCD00016557
Smiles:
CCOc1ccc(cc1)CCC(=O)O
Complexity:
171
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
5
Xlogp3:
2.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCc1ccc(cc1)C(=O)CCC(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCc1ccc(cc1)C(=O)CCC(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__