Cas no 3698-94-0 (Octane, 1-(ethylthio)-)
Octane, 1-(ethylthio)- structure
Product Name:Octane, 1-(ethylthio)-
Octane, 1-(ethylthio)- Chemical and Physical Properties
Names and Identifiers
-
- Octane, 1-(ethylthio)-
- 1-ethylsulfanyloctane
- ETHYL N-OCTYL SULFIDE
- 1-ethylsulfanyl-octane
- 3-Thiaundecane
- Aethyl-octyl-sulfid
- Ethyl octyl sulfide
- octyl ethyl sulfide
- 1-(ethylsulfanyl)octane
- CHEMBL3186809
- SULFIDE, ETHYL OCTYL
- 3698-94-0
- ETHYL N-OCTYL SULPHIDE
- Q27281617
- FT-0605827
- AKOS024334033
- Tox21_301893
- WAITXWGCJQLPGH-UHFFFAOYSA-N
- ETHYL 1-OCTYL SULFIDE
- NCGC00256022-01
- UNII-JOZ6D7U0VL
- J341.520A
- DTXSID4044662
- JOZ6D7U0VL
- ethyl(octyl)sulfane
- DTXCID2024662
- SCHEMBL200334
- CAS-3698-94-0
-
- Inchi： 1S/C10H22S/c1-3-5-6-7-8-9-10-11-4-2/h3-10H2,1-2H3
- InChI Key： WAITXWGCJQLPGH-UHFFFAOYSA-N
- SMILES： S(CC)CCCCCCCC
Computed Properties
- Exact Mass: 174.14400
- Monoisotopic Mass: 174.14422188g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 8
- Complexity: 61.9
- 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: 4.7
- Topological Polar Surface Area: 25.3?2
Experimental Properties
- Density: 0.8410
- Melting Point: -53.83°C (estimate)
- Boiling Point: 215.37°C (estimate)
- Refractive Index: 1.4465 (estimate)
- PSA: 25.30000
- LogP: 4.10000
Octane, 1-(ethylthio)- Customs Data
- HS CODE：2930909090
- Customs Data：
China Customs Code:
2930909090Overview:
2930909090. Other organic sulfur compounds. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:30.0%
Declaration elements:
Product Name, component content, use to
Summary:
2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%
Octane, 1-(ethylthio)- Related Literature
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Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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