AD50500
32890-92-9 | 2,3,4,6-Tetrafluorobenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AD50500
ChemicalName
2,3,4,6-Tetrafluorobenzoic acid
CasNumber
32890-92-9
MolecularFormula
C7H2F4O2
MolecularWeight
194.0832
MdlNumber
MFCD00039523
Smiles
OC(=O)c1c(F)cc(c(c1F)F)F
Complexity
211
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2
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CatalogNumber: AD50500
ChemicalName: 2,3,4,6-Tetrafluorobenzoic acid
CasNumber: 32890-92-9
MolecularFormula: C7H2F4O2
MolecularWeight: 194.0832
MdlNumber: MFCD00039523
Smiles: OC(=O)c1c(F)cc(c(c1F)F)F
Complexity: 211
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2
CatalogNumber:
AD50500
ChemicalName:
2,3,4,6-Tetrafluorobenzoic acid
CasNumber:
32890-92-9
MolecularFormula:
C7H2F4O2
MolecularWeight:
194.0832
MdlNumber:
MFCD00039523
Smiles:
OC(=O)c1c(F)cc(c(c1F)F)F
Complexity:
211
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2
CatalogNumber: AD50501
ChemicalName: 2-Hydroxy-4-(trifluoromethyl)benzoic acid
CasNumber: 328-90-5
MolecularFormula: C8H5F3O3
MolecularWeight: 206.11870960000002
MdlNumber: MFCD01529657
Smiles: OC(=O)c1ccc(cc1O)C(F)(F)F
Complexity: 226
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 3.5
CatalogNumber:
AD50501
ChemicalName:
2-Hydroxy-4-(trifluoromethyl)benzoic acid
CasNumber:
328-90-5
MolecularFormula:
C8H5F3O3
MolecularWeight:
206.11870960000002
MdlNumber:
MFCD01529657
Smiles:
OC(=O)c1ccc(cc1O)C(F)(F)F
Complexity:
226
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
3.5
CatalogNumber: __
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Smiles: [O-][N+](=O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
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Xlogp3: __
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Smiles:
[O-][N+](=O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
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Xlogp3:
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Smiles: [O-][N+](=O)O[C@@H]1CO[C@H]2[C@@H]1OC[C@@H]2O[C@@H]1OC(C(=O)O)[C@H]([C@@H]([C@@H]1O)O)O
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-][N+](=O)O[C@@H]1CO[C@H]2[C@@H]1OC[C@@H]2O[C@@H]1OC(C(=O)O)[C@H]([C@@H]([C@@H]1O)O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__