AD24904
1355247-77-6 | 2-Acetamido-4-fluoro-3-nitrotoluene
Manufacturer: A2B Chem
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CatalogNumber
AD24904
ChemicalName
2-Acetamido-4-fluoro-3-nitrotoluene
CasNumber
1355247-77-6
MolecularFormula
C9H9FN2O3
MolecularWeight
212.1778
MdlNumber
MFCD21332916
Smiles
CC(=O)Nc1c(C)ccc(c1[N+](=O)[O-])F
Complexity
267
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1.9
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CatalogNumber: AD24904
ChemicalName: 2-Acetamido-4-fluoro-3-nitrotoluene
CasNumber: 1355247-77-6
MolecularFormula: C9H9FN2O3
MolecularWeight: 212.1778
MdlNumber: MFCD21332916
Smiles: CC(=O)Nc1c(C)ccc(c1[N+](=O)[O-])F
Complexity: 267
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.9
CatalogNumber:
AD24904
ChemicalName:
2-Acetamido-4-fluoro-3-nitrotoluene
CasNumber:
1355247-77-6
MolecularFormula:
C9H9FN2O3
MolecularWeight:
212.1778
MdlNumber:
MFCD21332916
Smiles:
CC(=O)Nc1c(C)ccc(c1[N+](=O)[O-])F
Complexity:
267
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.9
CatalogNumber: AD24905
ChemicalName: 4-[3-(Benzyloxy)phenyl]-2-chlorobenzonitrile
CasNumber: 1355247-40-3
MolecularFormula: C20H14ClNO
MolecularWeight: 319.7843
MdlNumber: MFCD21333009
Smiles: N#Cc1ccc(cc1Cl)c1cccc(c1)OCc1ccccc1
Complexity: 411
Covalently-bondedUnitCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 4
Xlogp3: 5.4
CatalogNumber:
AD24905
ChemicalName:
4-[3-(Benzyloxy)phenyl]-2-chlorobenzonitrile
CasNumber:
1355247-40-3
MolecularFormula:
C20H14ClNO
MolecularWeight:
319.7843
MdlNumber:
MFCD21333009
Smiles:
N#Cc1ccc(cc1Cl)c1cccc(c1)OCc1ccccc1
Complexity:
411
Covalently-bondedUnitCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
4
Xlogp3:
5.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(N1CC(C1)COc1ccccc1[N+](=O)[O-])OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(N1CC(C1)COc1ccccc1[N+](=O)[O-])OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Fc1cccc(c1CN1CCCC1)Br
Complexity: 182
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 3
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Fc1cccc(c1CN1CCCC1)Br
Complexity:
182
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
3