AI62093
928136-78-1 | 4-Bromo-3-(trifluoromethoxy)benzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AI62093
ChemicalName
4-Bromo-3-(trifluoromethoxy)benzonitrile
CasNumber
928136-78-1
MolecularFormula
C8H3BrF3NO
MolecularWeight
266.0147
MdlNumber
MFCD22378817
Smiles
N#Cc1ccc(c(c1)OC(F)(F)F)Br
Complexity
247
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
5
RotatableBondCount
1
Xlogp3
3.5
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CatalogNumber: AI62093
ChemicalName: 4-Bromo-3-(trifluoromethoxy)benzonitrile
CasNumber: 928136-78-1
MolecularFormula: C8H3BrF3NO
MolecularWeight: 266.0147
MdlNumber: MFCD22378817
Smiles: N#Cc1ccc(c(c1)OC(F)(F)F)Br
Complexity: 247
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
RotatableBondCount: 1
Xlogp3: 3.5
CatalogNumber:
AI62093
ChemicalName:
4-Bromo-3-(trifluoromethoxy)benzonitrile
CasNumber:
928136-78-1
MolecularFormula:
C8H3BrF3NO
MolecularWeight:
266.0147
MdlNumber:
MFCD22378817
Smiles:
N#Cc1ccc(c(c1)OC(F)(F)F)Br
Complexity:
247
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
RotatableBondCount:
1
Xlogp3:
3.5
CatalogNumber: __
ChemicalName: __
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Smiles: CC(C)(C)[Si](C)(C)OCCC1=CN(C=N1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
CC(C)(C)[Si](C)(C)OCCC1=CN(C=N1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4
Complexity:
__
Covalently-bondedUnitCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: FC(S(=O)(=O)O)(F)F.ClS(=O)(=O)Cc1cccnc1
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
FC(S(=O)(=O)O)(F)F.ClS(=O)(=O)Cc1cccnc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: OB(c1ccc(nc1)N1CCSCC1)O
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
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ChemicalName:
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CasNumber:
__
MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
OB(c1ccc(nc1)N1CCSCC1)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__