Cas no 2432-54-4 (Butanethioic acid,S-hexyl ester)
2432-54-4 structure
Product Name:Butanethioic acid,S-hexyl ester
CAS No:2432-54-4
MF:C10H20OS
MW:188.330202102661
CID:251228
PubChem ID:551270
Update Time:2025-04-19
Butanethioic acid,S-hexyl ester Chemical and Physical Properties
Names and Identifiers
-
- Butanethioic acid,S-hexyl ester
- Butyricacid, thio-, S-hexyl ester (6CI,7CI,8CI)
- S-hexyl butanethioate
- DIPGYKKPXZRHQA-UHFFFAOYSA-N
- DTXSID70338807
- S-Hexyl butanethioate #
- Butyric acid, thio-, S-hexyl ester
- 2432-54-4
-
- Inchi： 1S/C10H20OS/c1-3-5-6-7-9-12-10(11)8-4-2/h3-9H2,1-2H3
- InChI Key： DIPGYKKPXZRHQA-UHFFFAOYSA-N
- SMILES： S(C(CCC)=O)CCCCCC
Computed Properties
- Exact Mass: 188.12348643g/mol
- Monoisotopic Mass: 188.12348643g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 8
- Complexity: 112
- 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
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 3.8
- Topological Polar Surface Area: 42.4?2
Butanethioic acid,S-hexyl ester Related Literature
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Eunju Nam,Jiyeon Han,Sunhee Choi,Mi Hee Lim Chem. Commun., 2021,57, 7637-7640
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
2432-54-4 (Butanethioic acid,S-hexyl ester) Related Products
- 2432-51-1(S-methyl butanethioate)
- 2432-77-1(S-Methyl thiohexanoate)
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- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
- 89640-58-4(2-Iodo-4-nitrophenylhydrazine)
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