AD47091
35090-76-7 | 5-Bromo-2-hydroxy-3-methoxybenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AD47091
ChemicalName
5-Bromo-2-hydroxy-3-methoxybenzoic acid
CasNumber
35090-76-7
MolecularFormula
C8H7BrO4
MolecularWeight
247.0428
MdlNumber
MFCD02258870
Smiles
COc1cc(Br)cc(c1O)C(=O)O
Complexity
197
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
2
Xlogp3
2.6
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CatalogNumber: AD47091
ChemicalName: 5-Bromo-2-hydroxy-3-methoxybenzoic acid
CasNumber: 35090-76-7
MolecularFormula: C8H7BrO4
MolecularWeight: 247.0428
MdlNumber: MFCD02258870
Smiles: COc1cc(Br)cc(c1O)C(=O)O
Complexity: 197
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 2.6
CatalogNumber:
AD47091
ChemicalName:
5-Bromo-2-hydroxy-3-methoxybenzoic acid
CasNumber:
35090-76-7
MolecularFormula:
C8H7BrO4
MolecularWeight:
247.0428
MdlNumber:
MFCD02258870
Smiles:
COc1cc(Br)cc(c1O)C(=O)O
Complexity:
197
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
2.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCC(c1ccccc1)C#N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCC(c1ccccc1)C#N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: ClCCCN1CCOC[C@@H]1C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
ClCCCN1CCOC[C@@H]1C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AD47097
ChemicalName: (+/-)-Trans-4-phenyl-pyrrolidine-3-carboxylic acid, HCl
CasNumber: 1049755-65-8
MolecularFormula: C11H14ClNO2
MolecularWeight: 227.6874
MdlNumber: MFCD06659254
Smiles: OC(=O)[C@@H]1CNC[C@H]1c1ccccc1.Cl
Complexity: 211
Covalently-bondedUnitCount: 2
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 3
RotatableBondCount: 2
Xlogp3: __
CatalogNumber:
AD47097
ChemicalName:
(+/-)-Trans-4-phenyl-pyrrolidine-3-carboxylic acid, HCl
CasNumber:
1049755-65-8
MolecularFormula:
C11H14ClNO2
MolecularWeight:
227.6874
MdlNumber:
MFCD06659254
Smiles:
OC(=O)[C@@H]1CNC[C@H]1c1ccccc1.Cl
Complexity:
211
Covalently-bondedUnitCount:
2
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
3
RotatableBondCount:
2
Xlogp3:
__