AB67639
616-82-0 | 4-Hydroxy-3-nitrobenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AB67639
ChemicalName
4-Hydroxy-3-nitrobenzoic acid
CasNumber
616-82-0
MolecularFormula
C7H5NO5
MolecularWeight
183.1183
MdlNumber
MFCD00007119
Smiles
OC(=O)c1ccc(c(c1)N(=O)=O)O
NscNumber
78436
Complexity
223
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
2
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CatalogNumber: AB67639
ChemicalName: 4-Hydroxy-3-nitrobenzoic acid
CasNumber: 616-82-0
MolecularFormula: C7H5NO5
MolecularWeight: 183.1183
MdlNumber: MFCD00007119
Smiles: OC(=O)c1ccc(c(c1)N(=O)=O)O
NscNumber: 78436
Complexity: 223
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 2
CatalogNumber:
AB67639
ChemicalName:
4-Hydroxy-3-nitrobenzoic acid
CasNumber:
616-82-0
MolecularFormula:
C7H5NO5
MolecularWeight:
183.1183
MdlNumber:
MFCD00007119
Smiles:
OC(=O)c1ccc(c(c1)N(=O)=O)O
NscNumber:
78436
Complexity:
223
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
2
CatalogNumber: AB67640
ChemicalName: 2-Nitro-4-(trifluoromethyl)phenol
CasNumber: 400-99-7
MolecularFormula: C7H4F3NO3
MolecularWeight: 207.1067696
MdlNumber: MFCD00009791
Smiles: O=N(=O)c1cc(ccc1O)C(F)(F)F
NscNumber: __
Complexity: 225
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: __
Xlogp3: 2.3
CatalogNumber:
AB67640
ChemicalName:
2-Nitro-4-(trifluoromethyl)phenol
CasNumber:
400-99-7
MolecularFormula:
C7H4F3NO3
MolecularWeight:
207.1067696
MdlNumber:
MFCD00009791
Smiles:
O=N(=O)c1cc(ccc1O)C(F)(F)F
NscNumber:
__
Complexity:
225
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
__
Xlogp3:
2.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-][N+](=O)c1cc(ccc1O)c1ccccc1
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-][N+](=O)c1cc(ccc1O)c1ccccc1
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-][N+](=O)c1cc(ccc1O)B1OC(C(O1)(C)C)(C)C
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-][N+](=O)c1cc(ccc1O)B1OC(C(O1)(C)C)(C)C
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__