AG29597
56030-19-4 | 3-(3-Formylphenyl)propanoic acid
Manufacturer: A2B Chem
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CatalogNumber
AG29597
ChemicalName
3-(3-Formylphenyl)propanoic acid
CasNumber
56030-19-4
MolecularFormula
C10H10O3
MolecularWeight
178.1846
MdlNumber
MFCD08234829
Smiles
O=Cc1cccc(c1)CCC(=O)O
Complexity
189
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
4
Xlogp3
1.1
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CatalogNumber: AG29597
ChemicalName: 3-(3-Formylphenyl)propanoic acid
CasNumber: 56030-19-4
MolecularFormula: C10H10O3
MolecularWeight: 178.1846
MdlNumber: MFCD08234829
Smiles: O=Cc1cccc(c1)CCC(=O)O
Complexity: 189
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 1.1
CatalogNumber:
AG29597
ChemicalName:
3-(3-Formylphenyl)propanoic acid
CasNumber:
56030-19-4
MolecularFormula:
C10H10O3
MolecularWeight:
178.1846
MdlNumber:
MFCD08234829
Smiles:
O=Cc1cccc(c1)CCC(=O)O
Complexity:
189
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
1.1
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
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Smiles: Cc1ccc(o1)/C=C/C=O
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularWeight:
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Smiles:
Cc1ccc(o1)/C=C/C=O
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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MolecularFormula: __
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Smiles: OC(=O)CCC1CCNCC1.Cl
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Xlogp3: __
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ChemicalName:
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MolecularWeight:
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Smiles:
OC(=O)CCC1CCNCC1.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
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Xlogp3:
__
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Smiles: COc1cnc(c(n1)N)Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1cnc(c(n1)N)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__