AB75865
773134-43-3 | Methyl 4-bromo-2-(methylsulfonyl)benzoate
Manufacturer: A2B Chem
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CatalogNumber
AB75865
ChemicalName
Methyl 4-bromo-2-(methylsulfonyl)benzoate
CasNumber
773134-43-3
MolecularFormula
C9H9BrO4S
MolecularWeight
293.1344
MdlNumber
MFCD06204242
Smiles
COC(=O)c1ccc(cc1S(=O)(=O)C)Br
Complexity
333
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
RotatableBondCount
3
Xlogp3
2.3
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CatalogNumber: AB75865
ChemicalName: Methyl 4-bromo-2-(methylsulfonyl)benzoate
CasNumber: 773134-43-3
MolecularFormula: C9H9BrO4S
MolecularWeight: 293.1344
MdlNumber: MFCD06204242
Smiles: COC(=O)c1ccc(cc1S(=O)(=O)C)Br
Complexity: 333
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: 2.3
CatalogNumber:
AB75865
ChemicalName:
Methyl 4-bromo-2-(methylsulfonyl)benzoate
CasNumber:
773134-43-3
MolecularFormula:
C9H9BrO4S
MolecularWeight:
293.1344
MdlNumber:
MFCD06204242
Smiles:
COC(=O)c1ccc(cc1S(=O)(=O)C)Br
Complexity:
333
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
2.3
CatalogNumber: AB75866
ChemicalName: Methyl 4-bromo-2-methylbenzoate
CasNumber: 99548-55-7
MolecularFormula: C9H9BrO2
MolecularWeight: 229.0706
MdlNumber: MFCD09954957
Smiles: COC(=O)c1ccc(cc1C)Br
Complexity: 170
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
Xlogp3: 3.4
CatalogNumber:
AB75866
ChemicalName:
Methyl 4-bromo-2-methylbenzoate
CasNumber:
99548-55-7
MolecularFormula:
C9H9BrO2
MolecularWeight:
229.0706
MdlNumber:
MFCD09954957
Smiles:
COC(=O)c1ccc(cc1C)Br
Complexity:
170
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
Xlogp3:
3.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1scc(c1O)Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1scc(c1O)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB75868
ChemicalName: Methyl 4-bromo-3-methoxybenzoate
CasNumber: 17100-63-9
MolecularFormula: C9H9BrO3
MolecularWeight: 245.06996
MdlNumber: MFCD08436018
Smiles: COC(=O)c1ccc(c(c1)OC)Br
Complexity: 184
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 2.8
CatalogNumber:
AB75868
ChemicalName:
Methyl 4-bromo-3-methoxybenzoate
CasNumber:
17100-63-9
MolecularFormula:
C9H9BrO3
MolecularWeight:
245.06996
MdlNumber:
MFCD08436018
Smiles:
COC(=O)c1ccc(c(c1)OC)Br
Complexity:
184
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
2.8