200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 88227-07-0
88227-07-0 | 2,6-Heptadienoic acid, 3,4-dimethyl-, ethyl ester, (E)-
CAS No: 88227-07-0 Catalog No: AG004B4N MDL No:
Product Description
Catalog Number:
AG004B4N
Chemical Name:
2,6-Heptadienoic acid, 3,4-dimethyl-, ethyl ester, (E)-
CAS Number:
88227-07-0
Molecular Formula:
C11H18O2
Molecular Weight:
182.2594
IUPAC Name:
ethyl 3,4-dimethylhepta-2,6-dienoate
InChI:
InChI=1S/C11H18O2/c1-5-7-9(3)10(4)8-11(12)13-6-2/h5,8-9H,1,6-7H2,2-4H3
InChI Key:
YJIKVBSNCAINFG-UHFFFAOYSA-N
SMILES:
C/C(=C\C(=O)OCC)/C(CC=C)C
Properties
Complexity:
204
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.131g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.263g/mol
Monoisotopic Mass:
182.131g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
3.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.