Cas no 23018-39-5 (Dibenzothiophene,1,4-dimethyl-, 5,5-dioxide)
23018-39-5 structure
Product Name:Dibenzothiophene,1,4-dimethyl-, 5,5-dioxide
CAS No:23018-39-5
MF:C14H12O2S
MW:244.308882713318
CID:287994
PubChem ID:273717
Update Time:2025-04-19
Dibenzothiophene,1,4-dimethyl-, 5,5-dioxide Chemical and Physical Properties
Names and Identifiers
-
- Dibenzothiophene,1,4-dimethyl-, 5,5-dioxide
- 1,4-dimethyldibenzothiophene 5,5-dioxide
- 1,4-dimethyldibenzo[b,d]thiophene 5,5-dioxide
- AC1L6TK6
- AC1Q6YZJ
- AG-J-48849
- AR-1B7833
- CTK4F0698
- KST-1B1947
- NSC119105
- DTXSID50297908
- 23018-39-5
- SCHEMBL12271286
- NSC-119105
-
- Inchi： 1S/C14H12O2S/c1-9-7-8-10(2)14-13(9)11-5-3-4-6-12(11)17(14,15)16/h3-8H,1-2H3
- InChI Key： KTTOUOWSFSXNQR-UHFFFAOYSA-N
- SMILES： S1(C2C=CC=CC=2C2C(C)=CC=C(C)C1=2)(=O)=O
Computed Properties
- Exact Mass: 244.05586
- Monoisotopic Mass: 244.05580079g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 17
- Rotatable Bond Count: 0
- Complexity: 395
- 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: 3.2
- Topological Polar Surface Area: 42.5?2
Experimental Properties
- PSA: 34.14
- LogP: 4.19740
Dibenzothiophene,1,4-dimethyl-, 5,5-dioxide Related Literature
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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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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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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