AD01533
933585-58-1 | Methyl 3-bromo-5-chlorobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AD01533
ChemicalName
Methyl 3-bromo-5-chlorobenzoate
CasNumber
933585-58-1
MolecularFormula
C8H6BrClO2
MolecularWeight
249.489
MdlNumber
MFCD07780734
Smiles
COC(=O)c1cc(Cl)cc(c1)Br
Complexity
174
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
2
RotatableBondCount
2
Xlogp3
3.5
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CatalogNumber: AD01533
ChemicalName: Methyl 3-bromo-5-chlorobenzoate
CasNumber: 933585-58-1
MolecularFormula: C8H6BrClO2
MolecularWeight: 249.489
MdlNumber: MFCD07780734
Smiles: COC(=O)c1cc(Cl)cc(c1)Br
Complexity: 174
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
Xlogp3: 3.5
CatalogNumber:
AD01533
ChemicalName:
Methyl 3-bromo-5-chlorobenzoate
CasNumber:
933585-58-1
MolecularFormula:
C8H6BrClO2
MolecularWeight:
249.489
MdlNumber:
MFCD07780734
Smiles:
COC(=O)c1cc(Cl)cc(c1)Br
Complexity:
174
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
Xlogp3:
3.5
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
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Smiles: CCOC(=O)c1cc(C)ccc1I
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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MolecularFormula:
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Smiles:
CCOC(=O)c1cc(C)ccc1I
Complexity:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: [O-][N+](=O)c1ccc2c(c1)nccc2Br
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Smiles:
[O-][N+](=O)c1ccc2c(c1)nccc2Br
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: CS(=O)(=O)Nc1ccc(cc1)S(=O)(=O)Cl
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
CS(=O)(=O)Nc1ccc(cc1)S(=O)(=O)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__