200,000+ products from a single source!
sales@angenechem.com
21691-04-3 | Cyclobuta[b]quinoline, 1,2-dihydro-, 3-oxide
CAS No: 21691-04-3 Catalog No: AG007PG9 MDL No:
Product Description
Catalog Number:
AG007PG9
Chemical Name:
Cyclobuta[b]quinoline, 1,2-dihydro-, 3-oxide
CAS Number:
21691-04-3
Molecular Formula:
C11H9NO
Molecular Weight:
171.1953
IUPAC Name:
3-oxido-1,2-dihydrocyclobuta[b]quinolin-3-ium
InChI:
InChI=1S/C11H9NO/c13-12-10-4-2-1-3-8(10)7-9-5-6-11(9)12/h1-4,7H,5-6H2
InChI Key:
HOPIOBBAWLYOQR-UHFFFAOYSA-N
SMILES:
[O-][n+]1c2CCc2cc2c1cccc2
Properties
Complexity:
206
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.068g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
171.199g/mol
Monoisotopic Mass:
171.068g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
Related Products
© 2019 Angene International Limited. All rights Reserved.