AF60950
42087-81-0 | Methyl 3-chloro-2-nitrobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AF60950
ChemicalName
Methyl 3-chloro-2-nitrobenzoate
CasNumber
42087-81-0
MolecularFormula
C8H6ClNO4
MolecularWeight
215.59054
MdlNumber
MFCD04038813
Smiles
[O-][N+](=O)c1c(cccc1Cl)C(=O)OC
Complexity
240
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
RotatableBondCount
2
Xlogp3
2.3
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CatalogNumber: AF60950
ChemicalName: Methyl 3-chloro-2-nitrobenzoate
CasNumber: 42087-81-0
MolecularFormula: C8H6ClNO4
MolecularWeight: 215.59054
MdlNumber: MFCD04038813
Smiles: [O-][N+](=O)c1c(cccc1Cl)C(=O)OC
Complexity: 240
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 2.3
CatalogNumber:
AF60950
ChemicalName:
Methyl 3-chloro-2-nitrobenzoate
CasNumber:
42087-81-0
MolecularFormula:
C8H6ClNO4
MolecularWeight:
215.59054
MdlNumber:
MFCD04038813
Smiles:
[O-][N+](=O)c1c(cccc1Cl)C(=O)OC
Complexity:
240
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
2.3
CatalogNumber: AF60951
ChemicalName: N-Phenyl 4-bromo-2-methoxybenzamide
CasNumber: 330793-39-0
MolecularFormula: C14H12BrNO2
MolecularWeight: 306.1546
MdlNumber: MFCD18087700
Smiles: COc1cc(Br)ccc1C(=O)Nc1ccccc1
Complexity: 279
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 2
RotatableBondCount: 3
Xlogp3: 4.3
CatalogNumber:
AF60951
ChemicalName:
N-Phenyl 4-bromo-2-methoxybenzamide
CasNumber:
330793-39-0
MolecularFormula:
C14H12BrNO2
MolecularWeight:
306.1546
MdlNumber:
MFCD18087700
Smiles:
COc1cc(Br)ccc1C(=O)Nc1ccccc1
Complexity:
279
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
2
RotatableBondCount:
3
Xlogp3:
4.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cc1cccc(c1)C(=O)NC(C)(C)C
Complexity: 205
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 3.1
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1cccc(c1)C(=O)NC(C)(C)C
Complexity:
205
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
3.1
CatalogNumber: AF60953
ChemicalName: 8-(Trifluoromethyl)quinoline
CasNumber: 317-57-7
MolecularFormula: C10H6F3N
MolecularWeight: 197.1565
MdlNumber: MFCD09744668
Smiles: FC(c1cccc2c1nccc2)(F)F
Complexity: 202
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
RotatableBondCount: __
Xlogp3: 2.5
CatalogNumber:
AF60953
ChemicalName:
8-(Trifluoromethyl)quinoline
CasNumber:
317-57-7
MolecularFormula:
C10H6F3N
MolecularWeight:
197.1565
MdlNumber:
MFCD09744668
Smiles:
FC(c1cccc2c1nccc2)(F)F
Complexity:
202
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
RotatableBondCount:
__
Xlogp3:
2.5