200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 115439-97-9
115439-97-9 | 9-Undecenoic acid, 11-[(3S)-3-pentyl-2-oxiranylidene]-, (9Z)-
CAS No: 115439-97-9 Catalog No: AG000G0P MDL No:
Product Description
Catalog Number:
AG000G0P
Chemical Name:
9-Undecenoic acid, 11-[(3S)-3-pentyl-2-oxiranylidene]-, (9Z)-
CAS Number:
115439-97-9
Molecular Formula:
C18H30O3
Molecular Weight:
294.4290
IUPAC Name:
11-[(3S)-3-pentyloxiran-2-ylidene]undec-9-enoic acid
InChI:
InChI=1S/C18H30O3/c1-2-3-10-13-16-17(21-16)14-11-8-6-4-5-7-9-12-15-18(19)20/h8,11,14,16H,2-7,9-10,12-13,15H2,1H3,(H,19,20)/t16-/m0/s1
InChI Key:
ZFVKKBAQVWQQHP-INIZCTEOSA-N
SMILES:
CCCCC[C@@H]1OC1=C/C=C\CCCCCCCC(=O)O
Properties
Complexity:
344
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
294.219g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
294.435g/mol
Monoisotopic Mass:
294.219g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
5.6
Literature
| Title | Journal |
|---|---|
| The allene oxide cyclase family of Arabidopsis thaliana: localization and cyclization. | The FEBS journal 20080501 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.