200,000+ products from a single source!
sales@angenechem.com
72229-98-2 | 2H-Cyclopent[b]isoxazolo[4,5-e]pyridine(9CI)
CAS No: 72229-98-2 Catalog No: AG005J5L MDL No:
Product Description
Catalog Number:
AG005J5L
Chemical Name:
2H-Cyclopent[b]isoxazolo[4,5-e]pyridine(9CI)
CAS Number:
72229-98-2
Molecular Formula:
C9H6N2O
Molecular Weight:
158.1567
IUPAC Name:
4-oxa-2,5-diazatricyclo[7.3.0.03,7]dodeca-1(12),2,6,8,10-pentaene
InChI:
InChI=1S/C9H6N2O/c1-2-6-4-7-5-10-12-9(7)11-8(6)3-1/h1-5,10H
InChI Key:
WXUROSOEPALRFO-UHFFFAOYSA-N
SMILES:
c1cc2c(c1)cc1c(n2)o[nH]c1
Properties
Complexity:
397
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.048g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
158.16g/mol
Monoisotopic Mass:
158.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
33.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.