AH86334
92379-10-7 | 2-(3-Hydroxyphenyl)benzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AH86334
ChemicalName
2-(3-Hydroxyphenyl)benzoic acid
CasNumber
92379-10-7
MolecularFormula
C13H10O3
MolecularWeight
214.2167
MdlNumber
MFCD04117371
Smiles
Oc1cccc(c1)c1ccccc1C(=O)O
Complexity
252
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
2
Xlogp3
2.5
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CatalogNumber: AH86334
ChemicalName: 2-(3-Hydroxyphenyl)benzoic acid
CasNumber: 92379-10-7
MolecularFormula: C13H10O3
MolecularWeight: 214.2167
MdlNumber: MFCD04117371
Smiles: Oc1cccc(c1)c1ccccc1C(=O)O
Complexity: 252
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 2.5
CatalogNumber:
AH86334
ChemicalName:
2-(3-Hydroxyphenyl)benzoic acid
CasNumber:
92379-10-7
MolecularFormula:
C13H10O3
MolecularWeight:
214.2167
MdlNumber:
MFCD04117371
Smiles:
Oc1cccc(c1)c1ccccc1C(=O)O
Complexity:
252
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
2.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O[C@H]1[C@@H](O)[C@@H](O[C@@H]1n1cnc2c1[nH]cnc2=O)OP(=O)(OP(=O)(O)O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O[C@H]1[C@@H](O)[C@@H](O[C@@H]1n1cnc2c1[nH]cnc2=O)OP(=O)(OP(=O)(O)O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)CCC1=C(CC(=O)OC)/C/2=C/c3[nH]c(c(c3CCC(=O)OC)CC(=O)OC)/C=C/3N=C(/C=c/4[nH]c(=CC1=N2)c(C)c4CCC(=O)OC)C(=C3CCC(=O)OC)CC(=O)OC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)CCC1=C(CC(=O)OC)/C/2=C/c3[nH]c(c(c3CCC(=O)OC)CC(=O)OC)/C=C/3N=C(/C=c/4[nH]c(=CC1=N2)c(C)c4CCC(=O)OC)C(=C3CCC(=O)OC)CC(=O)OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AH86337
ChemicalName: Potassium n-pentyltrifluoroborate
CasNumber: 872054-60-9
MolecularFormula: C5H10BF3K
MolecularWeight: 177.0374096
MdlNumber: MFCD07368249
Smiles: CCCC[CH-][B+3]([F-])([F-])[F-].[K+]
Complexity: 73.8
Covalently-bondedUnitCount: 2
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 3
Xlogp3: __
CatalogNumber:
AH86337
ChemicalName:
Potassium n-pentyltrifluoroborate
CasNumber:
872054-60-9
MolecularFormula:
C5H10BF3K
MolecularWeight:
177.0374096
MdlNumber:
MFCD07368249
Smiles:
CCCC[CH-][B+3]([F-])([F-])[F-].[K+]
Complexity:
73.8
Covalently-bondedUnitCount:
2
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
3
Xlogp3:
__