200,000+ products from a single source!
sales@angenechem.com
78620-15-2 | 1,3,4-Oxadiazol-2(3H)-one, 5-(5-chloro-2-benzoxazolyl)-
CAS No: 78620-15-2 Catalog No: AG005K30 MDL No:
Product Description
Catalog Number:
AG005K30
Chemical Name:
1,3,4-Oxadiazol-2(3H)-one, 5-(5-chloro-2-benzoxazolyl)-
CAS Number:
78620-15-2
Molecular Formula:
C9H4ClN3O3
Molecular Weight:
237.5994
IUPAC Name:
5-(5-chloro-1,3-benzoxazol-2-yl)-3H-1,3,4-oxadiazol-2-one
InChI:
InChI=1S/C9H4ClN3O3/c10-4-1-2-6-5(3-4)11-7(15-6)8-12-13-9(14)16-8/h1-3H,(H,13,14)
InChI Key:
NXIPAFMSTLUXKR-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(c1)nc(o2)c1n[nH]c(=O)o1
Properties
Complexity:
349
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.994g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
237.599g/mol
Monoisotopic Mass:
236.994g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
76.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.