AB65603
27996-86-7 | 4-(1H-1,2,4-Triazol-1-yl)benzaldehyde
Manufacturer: A2B Chem
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CatalogNumber
AB65603
ChemicalName
4-(1H-1,2,4-Triazol-1-yl)benzaldehyde
CasNumber
27996-86-7
MolecularFormula
C9H7N3O
MolecularWeight
173.1714
MdlNumber
MFCD02681969
Smiles
O=Cc1ccc(cc1)n1ncnc1
Complexity
178
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
RotatableBondCount
2
Xlogp3
1.1
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CatalogNumber: AB65603
ChemicalName: 4-(1H-1,2,4-Triazol-1-yl)benzaldehyde
CasNumber: 27996-86-7
MolecularFormula: C9H7N3O
MolecularWeight: 173.1714
MdlNumber: MFCD02681969
Smiles: O=Cc1ccc(cc1)n1ncnc1
Complexity: 178
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 1.1
CatalogNumber:
AB65603
ChemicalName:
4-(1H-1,2,4-Triazol-1-yl)benzaldehyde
CasNumber:
27996-86-7
MolecularFormula:
C9H7N3O
MolecularWeight:
173.1714
MdlNumber:
MFCD02681969
Smiles:
O=Cc1ccc(cc1)n1ncnc1
Complexity:
178
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
1.1
CatalogNumber: AB65604
ChemicalName: [4-(1H-1,2,4-Triazol-1-yl)phenyl]methanol
CasNumber: 143426-50-0
MolecularFormula: C9H9N3O
MolecularWeight: 175.1873
MdlNumber: MFCD02682061
Smiles: OCc1ccc(cc1)n1ncnc1
Complexity: 157
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 0.8
CatalogNumber:
AB65604
ChemicalName:
[4-(1H-1,2,4-Triazol-1-yl)phenyl]methanol
CasNumber:
143426-50-0
MolecularFormula:
C9H9N3O
MolecularWeight:
175.1873
MdlNumber:
MFCD02682061
Smiles:
OCc1ccc(cc1)n1ncnc1
Complexity:
157
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
0.8
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Smiles: Oc1ccc(cc1)n1ncnc1
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HydrogenBondAcceptorCount: __
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Smiles:
Oc1ccc(cc1)n1ncnc1
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: CC(=O)Nc1ccc(cc1)n1cnnc1
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Smiles:
CC(=O)Nc1ccc(cc1)n1cnnc1
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
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