AB59930
81029-03-0 | 2,3-Dimethyl-4-nitroanisole
Manufacturer: A2B Chem
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CatalogNumber
AB59930
ChemicalName
2,3-Dimethyl-4-nitroanisole
CasNumber
81029-03-0
MolecularFormula
C9H11NO3
MolecularWeight
181.1885
MdlNumber
MFCD00007163
Smiles
COc1ccc(c(c1C)C)[N+](=O)[O-]
Complexity
190
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
RotatableBondCount
1
Xlogp3
3
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CatalogNumber: AB59930
ChemicalName: 2,3-Dimethyl-4-nitroanisole
CasNumber: 81029-03-0
MolecularFormula: C9H11NO3
MolecularWeight: 181.1885
MdlNumber: MFCD00007163
Smiles: COc1ccc(c(c1C)C)[N+](=O)[O-]
Complexity: 190
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: 3
CatalogNumber:
AB59930
ChemicalName:
2,3-Dimethyl-4-nitroanisole
CasNumber:
81029-03-0
MolecularFormula:
C9H11NO3
MolecularWeight:
181.1885
MdlNumber:
MFCD00007163
Smiles:
COc1ccc(c(c1C)C)[N+](=O)[O-]
Complexity:
190
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
3
CatalogNumber: AB59931
ChemicalName: 2,3-Dimethyl-4-nitrophenol
CasNumber: 19499-93-5
MolecularFormula: C8H9NO3
MolecularWeight: 167.162
MdlNumber: MFCD00013744
Smiles: [O-][N+](=O)c1ccc(c(c1C)C)O
Complexity: 178
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
RotatableBondCount: __
Xlogp3: 1.4
CatalogNumber:
AB59931
ChemicalName:
2,3-Dimethyl-4-nitrophenol
CasNumber:
19499-93-5
MolecularFormula:
C8H9NO3
MolecularWeight:
167.162
MdlNumber:
MFCD00013744
Smiles:
[O-][N+](=O)c1ccc(c(c1C)C)O
Complexity:
178
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
RotatableBondCount:
__
Xlogp3:
1.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-][N+](=O)c1ccc2c(c1)c(C)c([nH]2)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-][N+](=O)c1ccc2c(c1)c(C)c([nH]2)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-][N+](=O)c1ccc(c(c1N)C)C
Complexity: 178
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2.4
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-][N+](=O)c1ccc(c(c1N)C)C
Complexity:
178
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2.4