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17609-96-0 | Butanoic acid, 2-methyl-, (2R)-5-methyl-2-(1-methylethenyl)-4-hexen-1-yl ester
CAS No: 17609-96-0 Catalog No: AG0021FI MDL No:
Product Description
Catalog Number:
AG0021FI
Chemical Name:
Butanoic acid, 2-methyl-, (2R)-5-methyl-2-(1-methylethenyl)-4-hexen-1-yl ester
CAS Number:
17609-96-0
Molecular Formula:
C15H26O2
Molecular Weight:
238.3657
IUPAC Name:
(5-methyl-2-prop-1-en-2-ylhex-4-enyl) 2-methylbutanoate
InChI:
InChI=1S/C15H26O2/c1-7-13(6)15(16)17-10-14(12(4)5)9-8-11(2)3/h8,13-14H,4,7,9-10H2,1-3,5-6H3
InChI Key:
WBUQEUATHWMFQO-UHFFFAOYSA-N
SMILES:
CCC(C(=O)OC[C@@H](C(=C)C)CC=C(C)C)C
Properties
Complexity:
285
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.193g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.371g/mol
Monoisotopic Mass:
238.193g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
5
Literature
| Title | Journal |
|---|---|
| Chirality and bioactivity of the sex pheromone of Madeira mealybug (Hemiptera: Pseudococcidae). | Journal of economic entomology 20110601 |
| Identification and synthesis of the sex pheromone of the Madeira mealybug, Phenacoccus madeirensis Green. | Journal of chemical ecology 20090601 |
| Olfactory discrimination among sex pheromone stereoisomers: chirality recognition by pink hibiscus mealybug males. | Chemical senses 20060901 |
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