200,000+ products from a single source!
sales@angenechem.com
Home > Aldehydes > 179056-04-3
179056-04-3 | Benzaldehyde, 4-(2H-1,2,3-triazol-2-yl)-
CAS No: 179056-04-3 Catalog No: AG0026QY MDL No:MFCD08669904
Product Description
Catalog Number:
AG0026QY
Chemical Name:
Benzaldehyde, 4-(2H-1,2,3-triazol-2-yl)-
CAS Number:
179056-04-3
Molecular Formula:
C9H7N3O
Molecular Weight:
173.1714
MDL Number:
MFCD08669904
IUPAC Name:
4-(triazol-2-yl)benzaldehyde
InChI:
InChI=1S/C9H7N3O/c13-7-8-1-3-9(4-2-8)12-10-5-6-11-12/h1-7H
InChI Key:
CTYWOTWHICQOMA-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)n1nccn1
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.059g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
173.175g/mol
Monoisotopic Mass:
173.059g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
47.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.