Cas no 83173-24-4 ((3Z,6Z,12E)-1-propyltetradeca-3,6,12-trien-1-yl 2-hydroxybenzoate)
83173-24-4 structure
Product Name:(3Z,6Z,12E)-1-propyltetradeca-3,6,12-trien-1-yl 2-hydroxybenzoate
CAS No:83173-24-4
MF:C24H34O3
MW:370.524967670441
CID:1807331
PubChem ID:10067772
Update Time:2025-04-21
(3Z,6Z,12E)-1-propyltetradeca-3,6,12-trien-1-yl 2-hydroxybenzoate Chemical and Physical Properties
Names and Identifiers
-
- (3Z,6Z,12E)-1-propyltetradeca-3,6,12-trien-1-yl 2-hydroxybenzoate
- [(6Z,9Z,15E)-heptadeca-6,9,15-trien-4-yl] 2-hydroxybenzoate
- DTXSID001172828
- CHEMBL33995
- LMPK15040005
- Benzoic acid, 2-(8Z,11Z,14Z)-8,11,14-heptadecatrienyl-6-hydroxy-
- 6-((8Z,11Z,14Z)-heptadeca-8,11,14-trien-1-yl)salicylic acid
- 2-[(8Z,11Z,14Z)-heptadeca-8,11,14-trienyl]-6-hydroxybenzoic acid
- CHEBI:186627
- BDBM50469657
- 83173-24-4
- AKOS040734281
- SB-202742
- 2-((8Z,11Z,14Z)-heptadeca-8,11,14-trien-1-yl)-6-hydroxybenzoic acid
-
- Inchi： 1S/C24H34O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-21-19-17-20-22(25)23(21)24(26)27/h3-4,6-7,9-10,17,19-20,25H,2,5,8,11-16,18H2,1H3,(H,26,27)/b4-3-,7-6-,10-9-
- InChI Key： MBYMHCHZLAJVRK-PDBXOOCHSA-N
- SMILES： OC1=CC=CC(=C1C(=O)O)CCCCCCC/C=C\C/C=C\C/C=C\CC
Computed Properties
- Exact Mass: 370.25079494g/mol
- Monoisotopic Mass: 370.25079494g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 27
- Rotatable Bond Count: 14
- Complexity: 464
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 3
- Undefined Bond Stereocenter Count: 0
- XLogP3: 8.3
- Topological Polar Surface Area: 57.5?2
(3Z,6Z,12E)-1-propyltetradeca-3,6,12-trien-1-yl 2-hydroxybenzoate Related Literature
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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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
-
Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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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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