AI45528
235428-18-9 | N-Ethyl-4-fluoro-3-nitrobenzamide
Manufacturer: A2B Chem
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CatalogNumber
AI45528
ChemicalName
N-Ethyl-4-fluoro-3-nitrobenzamide
CasNumber
235428-18-9
MolecularFormula
C9H9FN2O3
MolecularWeight
212.1778
MdlNumber
MFCD12166020
Smiles
CCNC(=O)c1ccc(c(c1)[N+](=O)[O-])F
Complexity
254
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1.5
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CatalogNumber: AI45528
ChemicalName: N-Ethyl-4-fluoro-3-nitrobenzamide
CasNumber: 235428-18-9
MolecularFormula: C9H9FN2O3
MolecularWeight: 212.1778
MdlNumber: MFCD12166020
Smiles: CCNC(=O)c1ccc(c(c1)[N+](=O)[O-])F
Complexity: 254
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.5
CatalogNumber:
AI45528
ChemicalName:
N-Ethyl-4-fluoro-3-nitrobenzamide
CasNumber:
235428-18-9
MolecularFormula:
C9H9FN2O3
MolecularWeight:
212.1778
MdlNumber:
MFCD12166020
Smiles:
CCNC(=O)c1ccc(c(c1)[N+](=O)[O-])F
Complexity:
254
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCC(N)(C)C.Br
Complexity: 42.8
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OCC(N)(C)C.Br
Complexity:
42.8
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)NC(=S)Nc1ccccc1NC(=S)NC(=O)OC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)NC(=S)Nc1ccccc1NC(=S)NC(=O)OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)C1(CCOCC1)CSC(=O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)C1(CCOCC1)CSC(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__