AA79646
157652-28-3 | Methyl 2-(bromomethyl)-4-fluorobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AA79646
ChemicalName
Methyl 2-(bromomethyl)-4-fluorobenzoate
CasNumber
157652-28-3
MolecularFormula
C9H8BrFO2
MolecularWeight
247.0610232
MdlNumber
MFCD11505951
Smiles
COC(=O)c1ccc(cc1CBr)F
Complexity
187
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
RotatableBondCount
3
Xlogp3
2.4
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CatalogNumber: AA79646
ChemicalName: Methyl 2-(bromomethyl)-4-fluorobenzoate
CasNumber: 157652-28-3
MolecularFormula: C9H8BrFO2
MolecularWeight: 247.0610232
MdlNumber: MFCD11505951
Smiles: COC(=O)c1ccc(cc1CBr)F
Complexity: 187
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 2.4
CatalogNumber:
AA79646
ChemicalName:
Methyl 2-(bromomethyl)-4-fluorobenzoate
CasNumber:
157652-28-3
MolecularFormula:
C9H8BrFO2
MolecularWeight:
247.0610232
MdlNumber:
MFCD11505951
Smiles:
COC(=O)c1ccc(cc1CBr)F
Complexity:
187
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
2.4
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
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Smiles: COC(=O)c1ccc(cc1CBr)C(F)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
COC(=O)c1ccc(cc1CBr)C(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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MolecularFormula: __
MolecularWeight: __
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Smiles: OC(=O)CC[C@@H](C(=O)O)N.Cl
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
__
MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
OC(=O)CC[C@@H](C(=O)O)N.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCN(CC)CCOC(=O)C1=C(C=C(C=C1)N)O.C1=CC(=C(C=C1N)O)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCN(CC)CCOC(=O)C1=C(C=C(C=C1)N)O.C1=CC(=C(C=C1N)O)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__