AI64585
95635-45-3 | N-(4-Chloro-2-fluoro-5-nitrophenyl)acetamide
Manufacturer: A2B Chem
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CatalogNumber
AI64585
ChemicalName
N-(4-Chloro-2-fluoro-5-nitrophenyl)acetamide
CasNumber
95635-45-3
MolecularFormula
C8H6ClFN2O3
MolecularWeight
232.5962
MdlNumber
MFCD24849669
Smiles
CC(=O)Nc1cc([N+](=O)[O-])c(cc1F)Cl
Complexity
271
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2
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CatalogNumber: AI64585
ChemicalName: N-(4-Chloro-2-fluoro-5-nitrophenyl)acetamide
CasNumber: 95635-45-3
MolecularFormula: C8H6ClFN2O3
MolecularWeight: 232.5962
MdlNumber: MFCD24849669
Smiles: CC(=O)Nc1cc([N+](=O)[O-])c(cc1F)Cl
Complexity: 271
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2
CatalogNumber:
AI64585
ChemicalName:
N-(4-Chloro-2-fluoro-5-nitrophenyl)acetamide
CasNumber:
95635-45-3
MolecularFormula:
C8H6ClFN2O3
MolecularWeight:
232.5962
MdlNumber:
MFCD24849669
Smiles:
CC(=O)Nc1cc([N+](=O)[O-])c(cc1F)Cl
Complexity:
271
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc(cc1Cn1cccn1)CN
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc(cc1Cn1cccn1)CN
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)CCc1c(C)nn(c1C)C
Complexity: 196
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 0.8
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)CCc1c(C)nn(c1C)C
Complexity:
196
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
0.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccccc1c1nn(cc1C(=O)O)Cc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccccc1c1nn(cc1C(=O)O)Cc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__