Cas no 18023-86-4 (1,2-Propanediol,3-(dodecylthio)-)
18023-86-4 structure
Product Name:1,2-Propanediol,3-(dodecylthio)-
CAS No:18023-86-4
MF:C15H32O2S
MW:276.478384017944
CID:162274
PubChem ID:86648
Update Time:2025-04-19
1,2-Propanediol,3-(dodecylthio)- Chemical and Physical Properties
Names and Identifiers
-
- 1,2-Propanediol,3-(dodecylthio)-
- 3-dodecylsulfanylpropane-1,2-diol
- 3-dodecylthiopropane-1,2-diol
- (2.3-Dihydroxy-propyl)-dodecyl-sulfid
- 1, 3-(dodecylthio)-
- 1-n-dodecylthio-2,3-propanediol
- 1-S-dodecyl-2,3-glycerol
- 2,3-Dihydroxypropyl dodecyl sulfide
- 3-dodecylmercapto-propane-1,2-diol
- 3-dodecylsulfanyl-propane-1,2-diol
- 3-Dodecylthio-1,2-propanediol
- 3-dodecylthiopropan-1,2-diol
- AC1L3C05
- AGN-PC-0D4VKI
- Glycerol 1-dodecyl
- NSC508906
- 3-(Dodecylthio)-1,2-propanediol
- Glycerol 1-dodecylthio ether
- QIPYUDGFTOQZHX-UHFFFAOYSA-N
- NSC 508906
- DTXSID10884792
- NSC-508906
- 3-dodecylthio-propane-1,2-diol
- AKOS018239279
- NS00052135
- 1,2-Propanediol, 3-(dodecylthio)-
- EINECS 241-934-0
- SCHEMBL4786158
- 18023-86-4
- SCHEMBL4786370
-
- Inchi： 1S/C15H32O2S/c1-2-3-4-5-6-7-8-9-10-11-12-18-14-15(17)13-16/h15-17H,2-14H2,1H3
- InChI Key： QIPYUDGFTOQZHX-UHFFFAOYSA-N
- SMILES： S(CC(CO)O)CCCCCCCCCCCC
Computed Properties
- Exact Mass: 276.21246
- Monoisotopic Mass: 276.212
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 18
- Rotatable Bond Count: 14
- Complexity: 153
- 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
- XLogP3: 5.2
- Topological Polar Surface Area: 65.8?2
Experimental Properties
- Density: 0.968
- Boiling Point: 412.2°C at 760 mmHg
- Flash Point: 200.2°C
- Refractive Index: 1.49
- PSA: 40.46
- LogP: 3.99370
1,2-Propanediol,3-(dodecylthio)- Related Literature
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
-
Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
-
Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
-
Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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