200,000+ products from a single source!
sales@angenechem.com
Home > Other Heterocycles > 88165-28-0
88165-28-0 | Bicyclo[4.2.0]octa-1,3,5-triene-7-propanal, 4-methoxy-
CAS No: 88165-28-0 Catalog No: AG004H1S MDL No:
Product Description
Catalog Number:
AG004H1S
Chemical Name:
Bicyclo[4.2.0]octa-1,3,5-triene-7-propanal, 4-methoxy-
CAS Number:
88165-28-0
Molecular Formula:
C12H14O2
Molecular Weight:
190.2384
IUPAC Name:
3-(4-methoxy-7-bicyclo[4.2.0]octa-1(6),2,4-trienyl)propanal
InChI:
InChI=1S/C12H14O2/c1-14-11-5-4-10-7-9(3-2-6-13)12(10)8-11/h4-6,8-9H,2-3,7H2,1H3
InChI Key:
NKVKYBDJUQJQKA-UHFFFAOYSA-N
SMILES:
COc1cc2C(CCC=O)Cc2cc1
Properties
Complexity:
203
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.099g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.242g/mol
Monoisotopic Mass:
190.099g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.