AB44994
453-71-4 | 4-Fluoro-3-nitrobenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AB44994
ChemicalName
4-Fluoro-3-nitrobenzoic acid
CasNumber
453-71-4
MolecularFormula
C7H4FNO4
MolecularWeight
185.1094
MdlNumber
MFCD00007058
Smiles
[O-][N+](=O)c1cc(ccc1F)C(=O)O
NscNumber
10311
Complexity
227
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1.9
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CatalogNumber: AB44994
ChemicalName: 4-Fluoro-3-nitrobenzoic acid
CasNumber: 453-71-4
MolecularFormula: C7H4FNO4
MolecularWeight: 185.1094
MdlNumber: MFCD00007058
Smiles: [O-][N+](=O)c1cc(ccc1F)C(=O)O
NscNumber: 10311
Complexity: 227
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.9
CatalogNumber:
AB44994
ChemicalName:
4-Fluoro-3-nitrobenzoic acid
CasNumber:
453-71-4
MolecularFormula:
C7H4FNO4
MolecularWeight:
185.1094
MdlNumber:
MFCD00007058
Smiles:
[O-][N+](=O)c1cc(ccc1F)C(=O)O
NscNumber:
10311
Complexity:
227
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.9
CatalogNumber: AB44995
ChemicalName: 4'-Fluoroacetophenone
CasNumber: 403-42-9
MolecularFormula: C8H7FO
MolecularWeight: 138.139
MdlNumber: MFCD00000354
Smiles: CC(=O)c1ccc(cc1)F
NscNumber: 30635
Complexity: 125
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 1.7
CatalogNumber:
AB44995
ChemicalName:
4'-Fluoroacetophenone
CasNumber:
403-42-9
MolecularFormula:
C8H7FO
MolecularWeight:
138.139
MdlNumber:
MFCD00000354
Smiles:
CC(=O)c1ccc(cc1)F
NscNumber:
30635
Complexity:
125
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
1.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc(cc1)F
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc(cc1)F
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=Cc1ccc(cc1)F
NscNumber: __
Complexity: 95.1
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 1.6
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=Cc1ccc(cc1)F
NscNumber:
__
Complexity:
95.1
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
1.6