200,000+ products from a single source!
sales@angenechem.com
Home > Aldehydes > 906352-62-3
906352-62-3 | 2-(1H-1,2,4-TRIAZOL-1-YLMETHYL)BENZALDEHYDE
CAS No: 906352-62-3 Catalog No: AG006NW8 MDL No:MFCD09025843
Product Description
Catalog Number:
AG006NW8
Chemical Name:
2-(1H-1,2,4-TRIAZOL-1-YLMETHYL)BENZALDEHYDE
CAS Number:
906352-62-3
Molecular Formula:
C10H9N3O
Molecular Weight:
187.1980
MDL Number:
MFCD09025843
IUPAC Name:
2-(1,2,4-triazol-1-ylmethyl)benzaldehyde
InChI:
InChI=1S/C10H9N3O/c14-6-10-4-2-1-3-9(10)5-13-8-11-7-12-13/h1-4,6-8H,5H2
InChI Key:
XPXZXSFDTOZFQQ-UHFFFAOYSA-N
SMILES:
O=Cc1ccccc1Cn1cncn1
Properties
Complexity:
198
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.075g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
187.202g/mol
Monoisotopic Mass:
187.075g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
47.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.