AF33221
27007-53-0 | Methyl 2-bromo-5-chlorobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AF33221
ChemicalName
Methyl 2-bromo-5-chlorobenzoate
CasNumber
27007-53-0
MolecularFormula
C8H6BrClO2
MolecularWeight
249.489
MdlNumber
MFCD00144763
Smiles
COC(=O)c1cc(Cl)ccc1Br
NscNumber
132246
Complexity
174
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
2
RotatableBondCount
2
Xlogp3
4.1
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CatalogNumber: AF33221
ChemicalName: Methyl 2-bromo-5-chlorobenzoate
CasNumber: 27007-53-0
MolecularFormula: C8H6BrClO2
MolecularWeight: 249.489
MdlNumber: MFCD00144763
Smiles: COC(=O)c1cc(Cl)ccc1Br
NscNumber: 132246
Complexity: 174
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
Xlogp3: 4.1
CatalogNumber:
AF33221
ChemicalName:
Methyl 2-bromo-5-chlorobenzoate
CasNumber:
27007-53-0
MolecularFormula:
C8H6BrClO2
MolecularWeight:
249.489
MdlNumber:
MFCD00144763
Smiles:
COC(=O)c1cc(Cl)ccc1Br
NscNumber:
132246
Complexity:
174
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
Xlogp3:
4.1
CatalogNumber: AF33222
ChemicalName: Methyl-(2R)-2-hydroxy-3-phenylpropanoate
CasNumber: 27000-00-6
MolecularFormula: C10H12O3
MolecularWeight: 180.2005
MdlNumber: MFCD09842268
Smiles: COC(=O)[C@@H](Cc1ccccc1)O
NscNumber: __
Complexity: 162
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
RotatableBondCount: 4
Xlogp3: 1.5
CatalogNumber:
AF33222
ChemicalName:
Methyl-(2R)-2-hydroxy-3-phenylpropanoate
CasNumber:
27000-00-6
MolecularFormula:
C10H12O3
MolecularWeight:
180.2005
MdlNumber:
MFCD09842268
Smiles:
COC(=O)[C@@H](Cc1ccccc1)O
NscNumber:
__
Complexity:
162
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
RotatableBondCount:
4
Xlogp3:
1.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)Cc1ccc(cc1Cl)F
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)Cc1ccc(cc1Cl)F
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)C(F)(F)F.NCCCCCN1C(=O)C=CC1=O
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)C(F)(F)F.NCCCCCN1C(=O)C=CC1=O
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__