Cas no 99837-97-5 (Dodecanoic acid, 12-hydroxy-, phenylmethyl ester)
99837-97-5 structure
Product Name:Dodecanoic acid, 12-hydroxy-, phenylmethyl ester
CAS No:99837-97-5
MF:C19H30O3
MW:306.439706325531
CID:750029
PubChem ID:12077613
Update Time:2025-04-19
Dodecanoic acid, 12-hydroxy-, phenylmethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Dodecanoic acid, 12-hydroxy-, phenylmethyl ester
- benzyl 12-hydroxydodecanoate
- DTXSID60477133
- NQOJORCGROAJNI-UHFFFAOYSA-N
- 99837-97-5
- 12-Hydroxydodecanoic acid benzyl ester
- SCHEMBL574387
-
- Inchi: 1S/C19H30O3/c20-16-12-7-5-3-1-2-4-6-11-15-19(21)22-17-18-13-9-8-10-14-18/h8-10,13-14,20H,1-7,11-12,15-17H2
- InChI Key: NQOJORCGROAJNI-UHFFFAOYSA-N
- SMILES: O(CC1C=CC=CC=1)C(CCCCCCCCCCCO)=O
Computed Properties
- Exact Mass: 306.21949481g/mol
- Monoisotopic Mass: 306.21949481g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 22
- Rotatable Bond Count: 14
- Complexity: 259
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 5.2
- Topological Polar Surface Area: 46.5?2
Dodecanoic acid, 12-hydroxy-, phenylmethyl ester Related Literature
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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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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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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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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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
99837-97-5 (Dodecanoic acid, 12-hydroxy-, phenylmethyl ester) Related Products
- 31161-71-4(Tetradecanoic acid,phenylmethyl ester)
- 103-40-2(Succinic Acid Monobenzyl Ester)
- 140-24-9(Dibenzyl sebacate)
- 103-43-5(dibenzyl succinate)
- 5396-89-4(Benzyl acetoacetate)
- 103-38-8(Benzyl isovalerate FCC)
- 103-37-7(Benzyl butyrate)
- 3089-55-2(Benzyl octyl adipate)
- 2451-84-5(Dibenzyl adipate)
- 189625-51-2(Octadecanedioic acid,1-(phenylmethyl) ester)
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