AB82669
893734-96-8 | 3-[4-(Methylsulfanyl)phenyl]benzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AB82669
ChemicalName
3-[4-(Methylsulfanyl)phenyl]benzonitrile
CasNumber
893734-96-8
MolecularFormula
C14H11NS
MolecularWeight
225.3088
MdlNumber
MFCD05980600
Smiles
CSc1ccc(cc1)c1cccc(c1)C#N
Complexity
259
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
2
RotatableBondCount
2
Xlogp3
3.8
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CatalogNumber: AB82669
ChemicalName: 3-[4-(Methylsulfanyl)phenyl]benzonitrile
CasNumber: 893734-96-8
MolecularFormula: C14H11NS
MolecularWeight: 225.3088
MdlNumber: MFCD05980600
Smiles: CSc1ccc(cc1)c1cccc(c1)C#N
Complexity: 259
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
Xlogp3: 3.8
CatalogNumber:
AB82669
ChemicalName:
3-[4-(Methylsulfanyl)phenyl]benzonitrile
CasNumber:
893734-96-8
MolecularFormula:
C14H11NS
MolecularWeight:
225.3088
MdlNumber:
MFCD05980600
Smiles:
CSc1ccc(cc1)c1cccc(c1)C#N
Complexity:
259
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
Xlogp3:
3.8
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MolecularFormula: __
MolecularWeight: __
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Smiles: Cc1ccc2c(c1)n(C)c(c2)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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MolecularFormula:
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Smiles:
Cc1ccc2c(c1)n(C)c(c2)C(=O)O
Complexity:
__
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__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
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ChemicalName: __
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MolecularFormula: __
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Smiles: CC(Nc1ccc(cc1C(=O)O)C)C
Complexity: __
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__
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MolecularFormula:
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Smiles:
CC(Nc1ccc(cc1C(=O)O)C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: O=Cc1ccc(cc1)Oc1ccc(c(c1)C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=Cc1ccc(cc1)Oc1ccc(c(c1)C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__