Cas no 104700-85-8 (Pentadecanoic acid,14-methyl-, 2,3-dihydroxypropyl ester (9CI))
104700-85-8 structure
Product Name:Pentadecanoic acid,14-methyl-, 2,3-dihydroxypropyl ester (9CI)
CAS No:104700-85-8
MF:C19H38O4
MW:330.502626895905
CID:168581
PubChem ID:128631
Update Time:2025-04-19
Pentadecanoic acid,14-methyl-, 2,3-dihydroxypropyl ester (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Pentadecanoic acid,14-methyl-, 2,3-dihydroxypropyl ester (9CI)
- 2,3-Dihydroxypropyl 14-methylpentadecanoate
- ACMC-1BQ4H
- AG-D-17265
- Aggreceride B
- CTK4A3241
- Pentadecanoic acid, 14-methyl-, 2,3-dihydroxypropyl ester
- 14-Methylpentadecanoic acid 2,3-dihydroxypropyl ester
- 104700-85-8
- SCHEMBL17866968
- DTXSID20909142
-
- Inchi： 1S/C19H38O4/c1-17(2)13-11-9-7-5-3-4-6-8-10-12-14-19(22)23-16-18(21)15-20/h17-18,20-21H,3-16H2,1-2H3
- InChI Key： UJXZLNLZBUWQKD-UHFFFAOYSA-N
- SMILES： O(CC(CO)O)C(CCCCCCCCCCCCC(C)C)=O
Computed Properties
- Exact Mass: 330.27714
- Monoisotopic Mass: 330.27700969g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 23
- Rotatable Bond Count: 17
- Complexity: 266
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: nothing
- Topological Polar Surface Area: 66.8?2
Experimental Properties
- PSA: 66.76
Pentadecanoic acid,14-methyl-, 2,3-dihydroxypropyl ester (9CI) Related Literature
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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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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