200,000+ products from a single source!
sales@angenechem.com
155085-55-5 | 1H-Benzotriazole-5-carboxylic acid, 7-hydroxy-
CAS No: 155085-55-5 Catalog No: AG001NL8 MDL No:
Product Description
Catalog Number:
AG001NL8
Chemical Name:
1H-Benzotriazole-5-carboxylic acid, 7-hydroxy-
CAS Number:
155085-55-5
Molecular Formula:
C7H5N3O3
Molecular Weight:
179.1329
IUPAC Name:
7-hydroxy-2H-benzotriazole-5-carboxylic acid
InChI:
InChI=1S/C7H5N3O3/c11-5-2-3(7(12)13)1-4-6(5)9-10-8-4/h1-2,11H,(H,12,13)(H,8,9,10)
InChI Key:
AICBDEMSWFCSTO-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(O)c2c(c1)nn[nH]2
Properties
Complexity:
223
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.033g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
179.135g/mol
Monoisotopic Mass:
179.033g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
99.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.