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Home > Aldehydes > 1782293-06-4
1782293-06-4 | 1-methyl-4-(propan-2-yl)-1H-1,2,3-triazole-5-carbaldehyde
CAS No: 1782293-06-4 Catalog No: AG01DQFY MDL No:
Product Description
Catalog Number:
AG01DQFY
Chemical Name:
1-methyl-4-(propan-2-yl)-1H-1,2,3-triazole-5-carbaldehyde
CAS Number:
1782293-06-4
Molecular Formula:
C7H11N3O
Molecular Weight:
153.1817
IUPAC Name:
3-methyl-5-propan-2-yltriazole-4-carbaldehyde
InChI:
InChI=1S/C7H11N3O/c1-5(2)7-6(4-11)10(3)9-8-7/h4-5H,1-3H3
InChI Key:
LVFKXDRLFFVHEW-UHFFFAOYSA-N
SMILES:
O=Cc1n(C)nnc1C(C)C
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
153.09g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
153.185g/mol
Monoisotopic Mass:
153.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
47.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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