AA88426
16588-17-3 | Ethyl 2-chloro-5-nitrobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AA88426
ChemicalName
Ethyl 2-chloro-5-nitrobenzoate
CasNumber
16588-17-3
MolecularFormula
C9H8ClNO4
MolecularWeight
229.6171
MdlNumber
MFCD00115803
Smiles
[O-][N+](=O)c1cc(C(=O)OCC)c(cc1)Cl
Complexity
253
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
RotatableBondCount
3
Xlogp3
2.7
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CatalogNumber: AA88426
ChemicalName: Ethyl 2-chloro-5-nitrobenzoate
CasNumber: 16588-17-3
MolecularFormula: C9H8ClNO4
MolecularWeight: 229.6171
MdlNumber: MFCD00115803
Smiles: [O-][N+](=O)c1cc(C(=O)OCC)c(cc1)Cl
Complexity: 253
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: 2.7
CatalogNumber:
AA88426
ChemicalName:
Ethyl 2-chloro-5-nitrobenzoate
CasNumber:
16588-17-3
MolecularFormula:
C9H8ClNO4
MolecularWeight:
229.6171
MdlNumber:
MFCD00115803
Smiles:
[O-][N+](=O)c1cc(C(=O)OCC)c(cc1)Cl
Complexity:
253
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
2.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)c1ccc(c(c1)[N+](=O)[O-])Cl
Complexity: 253
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2.5
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)c1ccc(c(c1)[N+](=O)[O-])Cl
Complexity:
253
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-][N+](=O)c1ccc(c(c1)C(=O)N)Cl
Complexity: 228
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 1.4
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-][N+](=O)c1ccc(c(c1)C(=O)N)Cl
Complexity:
228
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
1.4
CatalogNumber: AA88429
ChemicalName: 4-Chloro-3-nitrobenzamide
CasNumber: 16588-06-0
MolecularFormula: C7H5ClN2O3
MolecularWeight: 200.5792
MdlNumber: MFCD00017134
Smiles: [O-][N+](=O)c1cc(ccc1Cl)C(=O)N
Complexity: 228
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: 1.1
CatalogNumber:
AA88429
ChemicalName:
4-Chloro-3-nitrobenzamide
CasNumber:
16588-06-0
MolecularFormula:
C7H5ClN2O3
MolecularWeight:
200.5792
MdlNumber:
MFCD00017134
Smiles:
[O-][N+](=O)c1cc(ccc1Cl)C(=O)N
Complexity:
228
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
1.1