AD25479
1352318-41-2 | 2-[2-(Methylsulfanyl)phenyl]benzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AD25479
ChemicalName
2-[2-(Methylsulfanyl)phenyl]benzonitrile
CasNumber
1352318-41-2
MolecularFormula
C14H11NS
MolecularWeight
225.3088
MdlNumber
MFCD20529501
Smiles
CSc1ccccc1c1ccccc1C#N
Complexity
267
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
2
RotatableBondCount
2
Xlogp3
3.8
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CatalogNumber: AD25479
ChemicalName: 2-[2-(Methylsulfanyl)phenyl]benzonitrile
CasNumber: 1352318-41-2
MolecularFormula: C14H11NS
MolecularWeight: 225.3088
MdlNumber: MFCD20529501
Smiles: CSc1ccccc1c1ccccc1C#N
Complexity: 267
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
Xlogp3: 3.8
CatalogNumber:
AD25479
ChemicalName:
2-[2-(Methylsulfanyl)phenyl]benzonitrile
CasNumber:
1352318-41-2
MolecularFormula:
C14H11NS
MolecularWeight:
225.3088
MdlNumber:
MFCD20529501
Smiles:
CSc1ccccc1c1ccccc1C#N
Complexity:
267
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
Xlogp3:
3.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-][N+](=O)c1ccc(cc1)c1ccc(c(c1)C)F
Complexity: 271
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 3.8
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-][N+](=O)c1ccc(cc1)c1ccc(c(c1)C)F
Complexity:
271
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
3.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1c(N)cc(c(c1C)N)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1c(N)cc(c(c1C)N)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C=CCOC(C(F)(F)F)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C=CCOC(C(F)(F)F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__