AB52565
5337-09-7 | Methyl 2-bromo-3-nitrobenzoate
Manufacturer: A2B Chem
The price for this product is unavailable. Please request a quote
CatalogNumber
AB52565
ChemicalName
Methyl 2-bromo-3-nitrobenzoate
CasNumber
5337-09-7
MolecularFormula
C8H6BrNO4
MolecularWeight
260.04154
MdlNumber
MFCD00087891
Smiles
COC(=O)c1cccc(c1Br)[N+](=O)[O-]
Complexity
240
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
RotatableBondCount
2
Xlogp3
2.4
Compare Similar Items
Show Difference
CatalogNumber: AB52565
ChemicalName: Methyl 2-bromo-3-nitrobenzoate
CasNumber: 5337-09-7
MolecularFormula: C8H6BrNO4
MolecularWeight: 260.04154
MdlNumber: MFCD00087891
Smiles: COC(=O)c1cccc(c1Br)[N+](=O)[O-]
Complexity: 240
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 2.4
CatalogNumber:
AB52565
ChemicalName:
Methyl 2-bromo-3-nitrobenzoate
CasNumber:
5337-09-7
MolecularFormula:
C8H6BrNO4
MolecularWeight:
260.04154
MdlNumber:
MFCD00087891
Smiles:
COC(=O)c1cccc(c1Br)[N+](=O)[O-]
Complexity:
240
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
2.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cc1oc(c(c1)SC(=O)c1cocc1)C
Complexity: 244
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2.8
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1oc(c(c1)SC(=O)c1cocc1)C
Complexity:
244
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C([C@@H]1CCC(=O)N1Cc1ccccc1)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C([C@@H]1CCC(=O)N1Cc1ccccc1)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc2n(c1)nc(n2)N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc2n(c1)nc(n2)N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__