Cas no 3667-84-3 (Cyclododecanone,2-[[(4-methylphenyl)sulfonyl]oxy]-)
![Cyclododecanone,2-[[(4-methylphenyl)sulfonyl]oxy]- structure](https://ossimg.kuujia.com/scimg/4000/3667-84-3x500.png)
3667-84-3 structure
Product Name:Cyclododecanone,2-[[(4-methylphenyl)sulfonyl]oxy]-
CAS No:3667-84-3
MF:C19H28O4S
MW:352.488224983215
CID:319958
PubChem ID:317518
Update Time:2025-04-19
Cyclododecanone,2-[[(4-methylphenyl)sulfonyl]oxy]- Chemical and Physical Properties
Names and Identifiers
-
- Cyclododecanone,2-[[(4-methylphenyl)sulfonyl]oxy]-
- (2-oxocyclododecyl) 4-methylbenzenesulfonate
- 2-[[(4-METHYLPHENYL)SULFONYL]OXY]CYCLODODECANONE
- AC1L7W61
- NSC249777
- NSC-249777
- DTXSID60312090
- 3667-84-3
-
- Inchi： 1S/C19H28O4S/c1-16-12-14-17(15-13-16)24(21,22)23-19-11-9-7-5-3-2-4-6-8-10-18(19)20/h12-15,19H,2-11H2,1H3
- InChI Key： WKROSNASDKHTEZ-UHFFFAOYSA-N
- SMILES： S(C1C=CC(C)=CC=1)(=O)(=O)OC1C(CCCCCCCCCC1)=O
Computed Properties
- Exact Mass: 352.17094
- Monoisotopic Mass: 352.17083054g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 24
- Rotatable Bond Count: 3
- Complexity: 472
- 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: 5.5
- Topological Polar Surface Area: 68.8?2
Experimental Properties
- PSA: 60.44
- LogP: 5.63340
Cyclododecanone,2-[[(4-methylphenyl)sulfonyl]oxy]- Related Literature
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
-
Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
-
Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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