200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 83325-78-4
83325-78-4 | 1,2,4-Benzotriazine, 3-methyl-, 2-oxide
CAS No: 83325-78-4 Catalog No: AG0055TD MDL No:
Product Description
Catalog Number:
AG0055TD
Chemical Name:
1,2,4-Benzotriazine, 3-methyl-, 2-oxide
CAS Number:
83325-78-4
Molecular Formula:
C8H7N3O
Molecular Weight:
161.1607
IUPAC Name:
3-methyl-2-oxido-1,2,4-benzotriazin-2-ium
InChI:
InChI=1S/C8H7N3O/c1-6-9-7-4-2-3-5-8(7)10-11(6)12/h2-5H,1H3
InChI Key:
JOROFFXAIWLUQD-UHFFFAOYSA-N
SMILES:
Cc1nc2ccccc2n[n+]1[O-]
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.059g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
161.164g/mol
Monoisotopic Mass:
161.059g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
51.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.