Cas no 54576-32-8 (Butane,1,4-bis(ethylthio)-)
Butane,1,4-bis(ethylthio)- structure
Product Name:Butane,1,4-bis(ethylthio)-
CAS No:54576-32-8
MF:C8H18S2
MW:178.358520030975
CID:369211
PubChem ID:294545
Update Time:2025-04-19
Butane,1,4-bis(ethylthio)- Chemical and Physical Properties
Names and Identifiers
-
- Butane,1,4-bis(ethylthio)-
- 3,8-Dithiadecane
- 1,4-bis(ethylsulfanyl)butane
- Butane, 1,4-bis(ethylthio)-
- NSC163280
- VWVDTVNQHHSYBD-UHFFFAOYSA-N
- Q27893910
- 1,4-Bis(ethylsulfanyl)butane #
- 1,4-bis(ethylthio)butane
- Butane,4-bis(ethylthio)-
- UNII-IC01N3V65R
- NSC-163280
- FT-0640263
- DTXSID3022293
- AKOS006343519
- IC01N3V65R
- 54576-32-8
-
- Inchi： 1S/C8H18S2/c1-3-9-7-5-6-8-10-4-2/h3-8H2,1-2H3
- InChI Key： VWVDTVNQHHSYBD-UHFFFAOYSA-N
- SMILES： S(CC)CCCCSCC
Computed Properties
- Exact Mass: 178.08514
- Monoisotopic Mass: 178.084992
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 7
- Complexity: 47.2
- 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
- Topological Polar Surface Area: 50.6
- XLogP3: 3
Experimental Properties
- Density: 0.946
- Boiling Point: 245.2°C at 760 mmHg
- Flash Point: 93.6°C
- Refractive Index: 1.496
- PSA: 0
- LogP: 3.27280
Butane,1,4-bis(ethylthio)- Related Literature
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
-
Christian K. Rank,Alexander W. Jones,Tatjana Wall,Patrick Di Martino-Fumo,Sarah Schr?ck,Markus Gerhards,Frederic W. Patureau Chem. Commun., 2019,55, 13749-13752
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Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
54576-32-8 (Butane,1,4-bis(ethylthio)-) Related Products
- 168977-02-4(Hexane, 1,1'-[1,4-butanediylbis(thio)]bis-)
- 16967-04-7(Hexane, 1-(butylthio)-)
- 16900-07-5(Octane, 1-(butylthio)-)
- 26158-99-6(Pentane, 1-(ethylthio)-)
- 54815-22-4(3,9-Dithiaundecane)
- 6048-83-5(methyl 2-benzyloctahydro-3aH-isoindole-3a-carboxylate)
- 54934-53-1(Dodecane, 1-(heptylthio)-)
- 24768-44-3(Heptane, 1-(ethylthio)-)
- 63347-82-0(1-(4-decylsulfanylbutylsulfanyl)decane)
- 73987-20-9(1-(5-decylsulfanylpentylsulfanyl)decane)
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