AC68097
676494-55-6 | 3-Fluoro-4-(4-formylphenoxy)benzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AC68097
ChemicalName
3-Fluoro-4-(4-formylphenoxy)benzonitrile
CasNumber
676494-55-6
MolecularFormula
C14H8FNO2
MolecularWeight
241.21722319999995
MdlNumber
MFCD11111105
Smiles
O=Cc1ccc(cc1)Oc1ccc(cc1F)C#N
Complexity
330
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
4
RotatableBondCount
3
Xlogp3
2.7
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CatalogNumber: AC68097
ChemicalName: 3-Fluoro-4-(4-formylphenoxy)benzonitrile
CasNumber: 676494-55-6
MolecularFormula: C14H8FNO2
MolecularWeight: 241.21722319999995
MdlNumber: MFCD11111105
Smiles: O=Cc1ccc(cc1)Oc1ccc(cc1F)C#N
Complexity: 330
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: 2.7
CatalogNumber:
AC68097
ChemicalName:
3-Fluoro-4-(4-formylphenoxy)benzonitrile
CasNumber:
676494-55-6
MolecularFormula:
C14H8FNO2
MolecularWeight:
241.21722319999995
MdlNumber:
MFCD11111105
Smiles:
O=Cc1ccc(cc1)Oc1ccc(cc1F)C#N
Complexity:
330
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
2.7
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Smiles: Cn1nnnc1Cl
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
Cn1nnnc1Cl
Complexity:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: [O-]C(=O)N(c1cc(Cl)ccc1C)CCCC
Complexity: __
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HydrogenBondAcceptorCount: __
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__
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CasNumber:
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MolecularWeight:
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Smiles:
[O-]C(=O)N(c1cc(Cl)ccc1C)CCCC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: Clc1ccc2c(c1)n(cc2C(=O)O)C(C)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
Clc1ccc2c(c1)n(cc2C(=O)O)C(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__