AB49566
5722-93-0 | 2-Hydroxy-4,5-dimethoxybenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AB49566
ChemicalName
2-Hydroxy-4,5-dimethoxybenzoic acid
CasNumber
5722-93-0
MolecularFormula
C9H10O5
MolecularWeight
198.1727
MdlNumber
MFCD19441387
Smiles
COc1cc(C(=O)O)c(cc1OC)O
Complexity
205
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
3
Xlogp3
1.6
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CatalogNumber: AB49566
ChemicalName: 2-Hydroxy-4,5-dimethoxybenzoic acid
CasNumber: 5722-93-0
MolecularFormula: C9H10O5
MolecularWeight: 198.1727
MdlNumber: MFCD19441387
Smiles: COc1cc(C(=O)O)c(cc1OC)O
Complexity: 205
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: 1.6
CatalogNumber:
AB49566
ChemicalName:
2-Hydroxy-4,5-dimethoxybenzoic acid
CasNumber:
5722-93-0
MolecularFormula:
C9H10O5
MolecularWeight:
198.1727
MdlNumber:
MFCD19441387
Smiles:
COc1cc(C(=O)O)c(cc1OC)O
Complexity:
205
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
1.6
CatalogNumber: AB49567
ChemicalName: 5-Methyl-1h-pyrrole-2-carboxylic acid
CasNumber: 3757-53-7
MolecularFormula: C6H7NO2
MolecularWeight: 125.1253
MdlNumber: MFCD03011381
Smiles: Cc1ccc([nH]1)C(=O)O
Complexity: 124
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 1
CatalogNumber:
AB49567
ChemicalName:
5-Methyl-1h-pyrrole-2-carboxylic acid
CasNumber:
3757-53-7
MolecularFormula:
C6H7NO2
MolecularWeight:
125.1253
MdlNumber:
MFCD03011381
Smiles:
Cc1ccc([nH]1)C(=O)O
Complexity:
124
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
1
CatalogNumber: AB49568
ChemicalName: 4-Bromo-1-methylindazole
CasNumber: 365427-30-1
MolecularFormula: C8H7BrN2
MolecularWeight: 211.0586
MdlNumber: MFCD09870042
Smiles: Brc1cccc2c1cnn2C
Complexity: 151
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.3
CatalogNumber:
AB49568
ChemicalName:
4-Bromo-1-methylindazole
CasNumber:
365427-30-1
MolecularFormula:
C8H7BrN2
MolecularWeight:
211.0586
MdlNumber:
MFCD09870042
Smiles:
Brc1cccc2c1cnn2C
Complexity:
151
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C1CCN1.Cl
Complexity: 17.2
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C1CCN1.Cl
Complexity:
17.2
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__