200,000+ products from a single source!
sales@angenechem.com
175609-21-9 | 2,1,3-Benzoxadiazole, 5-(bromomethyl)-, 1-oxide
CAS No: 175609-21-9 Catalog No: AG00212F MDL No:
Product Description
Catalog Number:
AG00212F
Chemical Name:
2,1,3-Benzoxadiazole, 5-(bromomethyl)-, 1-oxide
CAS Number:
175609-21-9
Molecular Formula:
C7H5BrN2O2
Molecular Weight:
229.0308
IUPAC Name:
5-(bromomethyl)-1-oxido-2,1,3-benzoxadiazol-1-ium
InChI:
InChI=1S/C7H5BrN2O2/c8-4-5-1-2-7-6(3-5)9-12-10(7)11/h1-3H,4H2
InChI Key:
FUGGAZYOVMKPSP-UHFFFAOYSA-N
SMILES:
BrCc1ccc2c(c1)no[n+]2[O-]
Properties
Complexity:
170
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.953g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.033g/mol
Monoisotopic Mass:
227.953g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
51.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.