AH00294
56935-77-4 | 2-(2,2,2-Trifluoroethoxy)benzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AH00294
ChemicalName
2-(2,2,2-Trifluoroethoxy)benzonitrile
CasNumber
56935-77-4
MolecularFormula
C9H6F3NO
MolecularWeight
201.1452
MdlNumber
MFCD09859324
Smiles
N#Cc1ccccc1OCC(F)(F)F
Complexity
230
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
5
RotatableBondCount
2
Xlogp3
3.1
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CatalogNumber: AH00294
ChemicalName: 2-(2,2,2-Trifluoroethoxy)benzonitrile
CasNumber: 56935-77-4
MolecularFormula: C9H6F3NO
MolecularWeight: 201.1452
MdlNumber: MFCD09859324
Smiles: N#Cc1ccccc1OCC(F)(F)F
Complexity: 230
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
RotatableBondCount: 2
Xlogp3: 3.1
CatalogNumber:
AH00294
ChemicalName:
2-(2,2,2-Trifluoroethoxy)benzonitrile
CasNumber:
56935-77-4
MolecularFormula:
C9H6F3NO
MolecularWeight:
201.1452
MdlNumber:
MFCD09859324
Smiles:
N#Cc1ccccc1OCC(F)(F)F
Complexity:
230
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
RotatableBondCount:
2
Xlogp3:
3.1
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Smiles: OC(=O)CCC(=O)c1cccc(c1)C(F)(F)F
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
OC(=O)CCC(=O)c1cccc(c1)C(F)(F)F
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: Cc1nnc([nH]1)C=O
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Smiles:
Cc1nnc([nH]1)C=O
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
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Smiles: CC(=O)N1C(CCC1=O)C(=O)O
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CC(=O)N1C(CCC1=O)C(=O)O
Complexity:
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Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__