AF52082
25699-89-2 | 4-(1H-1,2,4-Triazol-1-yl)benzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AF52082
ChemicalName
4-(1H-1,2,4-Triazol-1-yl)benzonitrile
CasNumber
25699-89-2
MolecularFormula
C9H6N4
MolecularWeight
170.1707
MdlNumber
MFCD07368643
Smiles
N#Cc1ccc(cc1)n1ncnc1
Complexity
211
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
RotatableBondCount
1
Xlogp3
1.4
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CatalogNumber: AF52082
ChemicalName: 4-(1H-1,2,4-Triazol-1-yl)benzonitrile
CasNumber: 25699-89-2
MolecularFormula: C9H6N4
MolecularWeight: 170.1707
MdlNumber: MFCD07368643
Smiles: N#Cc1ccc(cc1)n1ncnc1
Complexity: 211
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: 1.4
CatalogNumber:
AF52082
ChemicalName:
4-(1H-1,2,4-Triazol-1-yl)benzonitrile
CasNumber:
25699-89-2
MolecularFormula:
C9H6N4
MolecularWeight:
170.1707
MdlNumber:
MFCD07368643
Smiles:
N#Cc1ccc(cc1)n1ncnc1
Complexity:
211
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
1.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: C1C2C=CC1C(C2C(=O)O)(C(=O)O)[N+](=O)[O-]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C1C2C=CC1C(C2C(=O)O)(C(=O)O)[N+](=O)[O-]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
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Smiles: C1C(=NC(=O)N1N=CC=CC2=CC=C(O2)[N+](=O)[O-])[O-].[K+]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
C1C(=NC(=O)N1N=CC=CC2=CC=C(O2)[N+](=O)[O-])[O-].[K+]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__