AE45725
1261823-31-7 | 2-Fluoro-3-formylbenzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AE45725
ChemicalName
2-Fluoro-3-formylbenzonitrile
CasNumber
1261823-31-7
MolecularFormula
C8H4FNO
MolecularWeight
149.1219
MdlNumber
MFCD18394005
Smiles
O=Cc1cccc(c1F)C#N
Complexity
196
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
3
RotatableBondCount
1
Xlogp3
1.2
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CatalogNumber: AE45725
ChemicalName: 2-Fluoro-3-formylbenzonitrile
CasNumber: 1261823-31-7
MolecularFormula: C8H4FNO
MolecularWeight: 149.1219
MdlNumber: MFCD18394005
Smiles: O=Cc1cccc(c1F)C#N
Complexity: 196
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: 1.2
CatalogNumber:
AE45725
ChemicalName:
2-Fluoro-3-formylbenzonitrile
CasNumber:
1261823-31-7
MolecularFormula:
C8H4FNO
MolecularWeight:
149.1219
MdlNumber:
MFCD18394005
Smiles:
O=Cc1cccc(c1F)C#N
Complexity:
196
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
1.2
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Smiles: COC(=O)c1cc(I)c(cc1F)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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__
MolecularFormula:
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Smiles:
COC(=O)c1cc(I)c(cc1F)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
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Smiles: O=C1CN(Cc2c1cccc2)S(=O)(=O)C
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Smiles:
O=C1CN(Cc2c1cccc2)S(=O)(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
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Smiles: CN1Cc2c(C1=O)cccc2B1OC(C(O1)(C)C)(C)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
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CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
CN1Cc2c(C1=O)cccc2B1OC(C(O1)(C)C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__