Cas no 21182-65-0 (2-hexadecyl-5-methylhydroquinone)
21182-65-0 structure
Product Name:2-hexadecyl-5-methylhydroquinone
CAS No:21182-65-0
MF:C23H40O2
MW:348.562507629395
CID:911277
PubChem ID:88813
Update Time:2025-04-19
2-hexadecyl-5-methylhydroquinone Chemical and Physical Properties
Names and Identifiers
-
- 2-hexadecyl-5-methylhydroquinone
- 2-hexadecyl-5-methylbenzene-1,4-diol
- NS00026806
- 21182-65-0
- DTXSID10175415
- EINECS 244-258-4
- SCHEMBL8092550
- HINXRUYNUJLKSX-UHFFFAOYSA-N
-
- Inchi： 1S/C23H40O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-19-22(24)20(2)18-23(21)25/h18-19,24-25H,3-17H2,1-2H3
- InChI Key： HINXRUYNUJLKSX-UHFFFAOYSA-N
- SMILES： OC1C=C(C)C(=CC=1CCCCCCCCCCCCCCCC)O
Computed Properties
- Exact Mass: 348.303
- Monoisotopic Mass: 348.302830514g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 25
- Rotatable Bond Count: 15
- Complexity: 292
- 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: 10
- Topological Polar Surface Area: 40.5?2
Experimental Properties
- PSA: 40.46
2-hexadecyl-5-methylhydroquinone Related Literature
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Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
-
Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
-
M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
21182-65-0 (2-hexadecyl-5-methylhydroquinone) Related Products
- 5284-29-7(2-N-Dodecylphenol)
- 18979-60-7(4-Propylbenzene-1,3-diol)
- 27193-86-8(2-Dodecylphenol)
- 1300-94-3(Amylmetacresol)
- 18979-61-8(4-Butylresorcinol)
- 136-77-6(Hexylresorcinol)
- 644-35-9(2-Propylphenol)
- 138-00-1(2,4-Di-tert-amyl phenol)
- 13331-19-6(2-Propylbenzene-1,3-diol)
- 1687-61-2(2-Ethyl-5-methylphenol)
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