AA95553
180302-35-6 | 3-Cyano-4-fluorobenzyl bromide
Manufacturer: A2B Chem
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CatalogNumber
AA95553
ChemicalName
3-Cyano-4-fluorobenzyl bromide
CasNumber
180302-35-6
MolecularFormula
C8H5BrFN
MolecularWeight
214.0344
MdlNumber
MFCD03094341
Smiles
BrCc1ccc(c(c1)C#N)F
Complexity
174
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
2
RotatableBondCount
1
Xlogp3
2.3
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CatalogNumber: AA95553
ChemicalName: 3-Cyano-4-fluorobenzyl bromide
CasNumber: 180302-35-6
MolecularFormula: C8H5BrFN
MolecularWeight: 214.0344
MdlNumber: MFCD03094341
Smiles: BrCc1ccc(c(c1)C#N)F
Complexity: 174
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: 2.3
CatalogNumber:
AA95553
ChemicalName:
3-Cyano-4-fluorobenzyl bromide
CasNumber:
180302-35-6
MolecularFormula:
C8H5BrFN
MolecularWeight:
214.0344
MdlNumber:
MFCD03094341
Smiles:
BrCc1ccc(c(c1)C#N)F
Complexity:
174
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
2.3
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Smiles: Nc1ccn(c(=O)n1)[C@@H]1O[C@@H]([C@]([C@H]1O)(O)C#C)CO
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Xlogp3: __
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Smiles:
Nc1ccn(c(=O)n1)[C@@H]1O[C@@H]([C@]([C@H]1O)(O)C#C)CO
Complexity:
__
Covalently-bondedUnitCount:
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RotatableBondCount:
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Smiles: [N-]=[N+]=Nc1c(F)c(F)c(c(c1F)F)CBr
Complexity: __
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Smiles:
[N-]=[N+]=Nc1c(F)c(F)c(c(c1F)F)CBr
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: N=C(NC(=N)N)NCc1ccccc1
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
N=C(NC(=N)N)NCc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__