AE44798
13987-45-6 | 5-(3-Carboxy-4-hydroxyphenyl)-2-hydroxybenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AE44798
ChemicalName
5-(3-Carboxy-4-hydroxyphenyl)-2-hydroxybenzoic acid
CasNumber
13987-45-6
MolecularFormula
C14H10O6
MolecularWeight
274.2256
MdlNumber
MFCD24448851
Smiles
OC(=O)c1cc(ccc1O)c1ccc(c(c1)C(=O)O)O
Complexity
346
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
4
RotatableBondCount
3
Xlogp3
3
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CatalogNumber: AE44798
ChemicalName: 5-(3-Carboxy-4-hydroxyphenyl)-2-hydroxybenzoic acid
CasNumber: 13987-45-6
MolecularFormula: C14H10O6
MolecularWeight: 274.2256
MdlNumber: MFCD24448851
Smiles: OC(=O)c1cc(ccc1O)c1ccc(c(c1)C(=O)O)O
Complexity: 346
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 4
RotatableBondCount: 3
Xlogp3: 3
CatalogNumber:
AE44798
ChemicalName:
5-(3-Carboxy-4-hydroxyphenyl)-2-hydroxybenzoic acid
CasNumber:
13987-45-6
MolecularFormula:
C14H10O6
MolecularWeight:
274.2256
MdlNumber:
MFCD24448851
Smiles:
OC(=O)c1cc(ccc1O)c1ccc(c(c1)C(=O)O)O
Complexity:
346
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
4
RotatableBondCount:
3
Xlogp3:
3
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MolecularFormula: __
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Smiles: OC(=O)c1cnn2c1CNCC2
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularWeight:
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Smiles:
OC(=O)c1cnn2c1CNCC2
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: Brc1cccc2c1oc1c(Br)cccc1c2=O
Complexity: __
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Smiles:
Brc1cccc2c1oc1c(Br)cccc1c2=O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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MolecularFormula: __
MolecularWeight: __
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Smiles: O=Cc1cncc(c1C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=Cc1cncc(c1C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__