AB66023
22821-76-7 | 4-(Methylsulfonyl)benzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AB66023
ChemicalName
4-(Methylsulfonyl)benzonitrile
CasNumber
22821-76-7
MolecularFormula
C8H7NO2S
MolecularWeight
181.21168000000003
MdlNumber
MFCD00216489
Smiles
N#Cc1ccc(cc1)S(=O)(=O)C
Complexity
285
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
RotatableBondCount
1
Xlogp3
0.9
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CatalogNumber: AB66023
ChemicalName: 4-(Methylsulfonyl)benzonitrile
CasNumber: 22821-76-7
MolecularFormula: C8H7NO2S
MolecularWeight: 181.21168000000003
MdlNumber: MFCD00216489
Smiles: N#Cc1ccc(cc1)S(=O)(=O)C
Complexity: 285
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: 0.9
CatalogNumber:
AB66023
ChemicalName:
4-(Methylsulfonyl)benzonitrile
CasNumber:
22821-76-7
MolecularFormula:
C8H7NO2S
MolecularWeight:
181.21168000000003
MdlNumber:
MFCD00216489
Smiles:
N#Cc1ccc(cc1)S(=O)(=O)C
Complexity:
285
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
0.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NCc1ccc(cc1)S(=O)(=O)C
Complexity: 222
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 1.5
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NCc1ccc(cc1)S(=O)(=O)C
Complexity:
222
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
1.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NCc1ccc(cc1)S(=O)(=O)C.Cl
Complexity: 222
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NCc1ccc(cc1)S(=O)(=O)C.Cl
Complexity:
222
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)Cc1ccc(cc1)NS(=O)(=O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)Cc1ccc(cc1)NS(=O)(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__