AB65661
38628-51-2 | 3-(4-Carboxyphenyl)propionic acid
Manufacturer: A2B Chem
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CatalogNumber
AB65661
ChemicalName
3-(4-Carboxyphenyl)propionic acid
CasNumber
38628-51-2
MolecularFormula
C10H10O4
MolecularWeight
194.184
MdlNumber
MFCD00016560
Smiles
OC(=O)CCc1ccc(cc1)C(=O)O
Complexity
216
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
4
Xlogp3
1
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CatalogNumber: AB65661
ChemicalName: 3-(4-Carboxyphenyl)propionic acid
CasNumber: 38628-51-2
MolecularFormula: C10H10O4
MolecularWeight: 194.184
MdlNumber: MFCD00016560
Smiles: OC(=O)CCc1ccc(cc1)C(=O)O
Complexity: 216
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 4
Xlogp3: 1
CatalogNumber:
AB65661
ChemicalName:
3-(4-Carboxyphenyl)propionic acid
CasNumber:
38628-51-2
MolecularFormula:
C10H10O4
MolecularWeight:
194.184
MdlNumber:
MFCD00016560
Smiles:
OC(=O)CCc1ccc(cc1)C(=O)O
Complexity:
216
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
4
Xlogp3:
1
CatalogNumber: AB65662
ChemicalName: 4-Carboxycinnamic acid
CasNumber: 19675-63-9
MolecularFormula: C10H8O4
MolecularWeight: 192.1681
MdlNumber: MFCD00016543
Smiles: OC(=O)/C=C/c1ccc(cc1)C(=O)O
Complexity: 249
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: 1.3
CatalogNumber:
AB65662
ChemicalName:
4-Carboxycinnamic acid
CasNumber:
19675-63-9
MolecularFormula:
C10H8O4
MolecularWeight:
192.1681
MdlNumber:
MFCD00016543
Smiles:
OC(=O)/C=C/c1ccc(cc1)C(=O)O
Complexity:
249
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
1.3
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
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Smiles: Clc1ccc(cc1OC1CCNCC1)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
Clc1ccc(cc1OC1CCNCC1)C
Complexity:
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HeavyAtomCount:
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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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Smiles: ClCC(=O)NC1CC(C)(C)N(C(C1)(C)C)[O]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
ClCC(=O)NC1CC(C)(C)N(C(C1)(C)C)[O]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__