Cas no 18287-25-7 (12,15-Octadecadienoic acid, methyl ester, (Z,Z)-)
18287-25-7 structure
Product Name:12,15-Octadecadienoic acid, methyl ester, (Z,Z)-
CAS No:18287-25-7
MF:C19H34O2
MW:294.472066402435
CID:1376396
PubChem ID:5365571
Update Time:2025-04-20
12,15-Octadecadienoic acid, methyl ester, (Z,Z)- Chemical and Physical Properties
Names and Identifiers
-
- 12,15-Octadecadienoic acid, methyl ester, (Z,Z)-
- (12Z,15Z)-12,15-Octadecadienoic acid methyl ester
- methyl (12E,15E)-octadeca-12,15-dienoate
- 18287-25-7
- SQXLGHNKHZNVRT-AOSYACOCSA-N
- Methyl (12E,15E)-12,15-octadecadienoate #
- 12,15-Octadecadienoic acid, methyl ester
-
- Inchi： 1S/C19H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h4-5,7-8H,3,6,9-18H2,1-2H3/b5-4+,8-7+
- InChI Key： SQXLGHNKHZNVRT-AOSYACOCSA-N
- SMILES： O(C)C(CCCCCCCCCC/C=C/C/C=C/CC)=O
Computed Properties
- Exact Mass: 294.25602
- Monoisotopic Mass: 294.256
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 21
- Rotatable Bond Count: 15
- Complexity: 279
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 2
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 26.3A^2
- XLogP3: 6.9
Experimental Properties
- PSA: 26.3
12,15-Octadecadienoic acid, methyl ester, (Z,Z)- Related Literature
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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