AB42297
310390-60-4 | 3-Chloro-6-methoxy-1-benzothiophene-2-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AB42297
ChemicalName
3-Chloro-6-methoxy-1-benzothiophene-2-carboxylic acid
CasNumber
310390-60-4
MolecularFormula
C10H7ClO3S
MolecularWeight
242.67877999999996
MdlNumber
MFCD00448910
Smiles
COc1ccc2c(c1)sc(c2Cl)C(=O)O
Complexity
261
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
3.4
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CatalogNumber: AB42297
ChemicalName: 3-Chloro-6-methoxy-1-benzothiophene-2-carboxylic acid
CasNumber: 310390-60-4
MolecularFormula: C10H7ClO3S
MolecularWeight: 242.67877999999996
MdlNumber: MFCD00448910
Smiles: COc1ccc2c(c1)sc(c2Cl)C(=O)O
Complexity: 261
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 3.4
CatalogNumber:
AB42297
ChemicalName:
3-Chloro-6-methoxy-1-benzothiophene-2-carboxylic acid
CasNumber:
310390-60-4
MolecularFormula:
C10H7ClO3S
MolecularWeight:
242.67877999999996
MdlNumber:
MFCD00448910
Smiles:
COc1ccc2c(c1)sc(c2Cl)C(=O)O
Complexity:
261
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
3.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1C=C(CC(C1)(C)C)N(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1C=C(CC(C1)(C)C)N(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Ic1c(cc(cc1C(C)(C)C)C(C)(C)C)C(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Ic1c(cc(cc1C(C)(C)C)C(C)(C)C)C(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1N(c2ccccc2)C(=O)c2c1c(Cl)c(c(c2Cl)Cl)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1N(c2ccccc2)C(=O)c2c1c(Cl)c(c(c2Cl)Cl)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__