AA48281
132927-08-3 | 2-Methoxy-4-(trifluoromethyl)benzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AA48281
ChemicalName
2-Methoxy-4-(trifluoromethyl)benzonitrile
CasNumber
132927-08-3
MolecularFormula
C9H6F3NO
MolecularWeight
201.1452
MdlNumber
MFCD02101784
Smiles
COc1cc(ccc1C#N)C(F)(F)F
Complexity
242
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
5
RotatableBondCount
1
Xlogp3
2.5
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CatalogNumber: AA48281
ChemicalName: 2-Methoxy-4-(trifluoromethyl)benzonitrile
CasNumber: 132927-08-3
MolecularFormula: C9H6F3NO
MolecularWeight: 201.1452
MdlNumber: MFCD02101784
Smiles: COc1cc(ccc1C#N)C(F)(F)F
Complexity: 242
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
RotatableBondCount: 1
Xlogp3: 2.5
CatalogNumber:
AA48281
ChemicalName:
2-Methoxy-4-(trifluoromethyl)benzonitrile
CasNumber:
132927-08-3
MolecularFormula:
C9H6F3NO
MolecularWeight:
201.1452
MdlNumber:
MFCD02101784
Smiles:
COc1cc(ccc1C#N)C(F)(F)F
Complexity:
242
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
RotatableBondCount:
1
Xlogp3:
2.5
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Smiles: ClC1=CCCCCC1
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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Smiles:
ClC1=CCCCCC1
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: CC(/N=C(c1ccccc1O)/C)C/N=C(/c1ccccc1O)C
Complexity: __
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HeavyAtomCount: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
CC(/N=C(c1ccccc1O)/C)C/N=C(/c1ccccc1O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: Oc1ccc2c(c1C=NCc1ccccc1)cccc2
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Oc1ccc2c(c1C=NCc1ccccc1)cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__