AI65385
97-10-9 | 4-(Methylsulfonyl)-2-nitrophenol
Manufacturer: A2B Chem
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CatalogNumber
AI65385
ChemicalName
4-(Methylsulfonyl)-2-nitrophenol
CasNumber
97-10-9
MolecularFormula
C7H7NO5S
MolecularWeight
217.1992
MdlNumber
MFCD00085946
Smiles
[O-][N+](=O)c1cc(ccc1O)S(=O)(=O)C
Complexity
314
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1.1
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CatalogNumber: AI65385
ChemicalName: 4-(Methylsulfonyl)-2-nitrophenol
CasNumber: 97-10-9
MolecularFormula: C7H7NO5S
MolecularWeight: 217.1992
MdlNumber: MFCD00085946
Smiles: [O-][N+](=O)c1cc(ccc1O)S(=O)(=O)C
Complexity: 314
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.1
CatalogNumber:
AI65385
ChemicalName:
4-(Methylsulfonyl)-2-nitrophenol
CasNumber:
97-10-9
MolecularFormula:
C7H7NO5S
MolecularWeight:
217.1992
MdlNumber:
MFCD00085946
Smiles:
[O-][N+](=O)c1cc(ccc1O)S(=O)(=O)C
Complexity:
314
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Oc1ccc(c(c1)O)Sc1ccc(cc1O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Oc1ccc(c(c1)O)Sc1ccc(cc1O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AI65387
ChemicalName: Fast red itr
CasNumber: 97-35-8
MolecularFormula: C11H18N2O3S
MolecularWeight: 258.3372
MdlNumber: MFCD00009045
Smiles: CCN(S(=O)(=O)c1ccc(c(c1)N)OC)CC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
AI65387
ChemicalName:
Fast red itr
CasNumber:
97-35-8
MolecularFormula:
C11H18N2O3S
MolecularWeight:
258.3372
MdlNumber:
MFCD00009045
Smiles:
CCN(S(=O)(=O)c1ccc(c(c1)N)OC)CC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCC(=O)OC1CC(CC=C1C)C(=C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCC(=O)OC1CC(CC=C1C)C(=C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__