Cas no 17960-38-2 (2-Thiophenebutanenitrile,g-oxo-)
17960-38-2 structure
Product Name:2-Thiophenebutanenitrile,g-oxo-
CAS No:17960-38-2
MF:C8H7NOS
MW:165.212280511856
CID:122681
PubChem ID:4461944
Update Time:2025-04-18
2-Thiophenebutanenitrile,g-oxo- Chemical and Physical Properties
Names and Identifiers
-
- 2-Thiophenebutanenitrile,g-oxo-
- 4-oxo-4-thiophen-2-ylbutanenitrile
- 2-Thiophenebutanenitrile,g-oxo
- 4-oxo-4-thiophen-2-yl-butyronitrile
- gamma-Oxo-2-thiophenebutanenitrile
- 4-OXO-4-(2-THIENYL)BUTYRONITRILE
- 4-OXO-4-(THIOPHEN-2-YL)BUTANENITRILE
- DTXSID40403536
- 4-oxo-4-(2-thienyl)butanenitrile
- AKOS006275146
- 2-Thiophenebutanenitrile, gamma-oxo-
- 17960-38-2
- SCHEMBL21758874
-
- Inchi： 1S/C8H7NOS/c9-5-1-3-7(10)8-4-2-6-11-8/h2,4,6H,1,3H2
- InChI Key： RBXODNAKMVHVJB-UHFFFAOYSA-N
- SMILES： S1C=CC=C1C(CCC#N)=O
Computed Properties
- Exact Mass: 165.02500
- Monoisotopic Mass: 165.02483502g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 3
- Complexity: 194
- 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: 0.9
- Topological Polar Surface Area: 69.1?2
Experimental Properties
- Density: 1.207
- Melting Point: 66 oC
- PSA: 69.10000
- LogP: 2.23458
2-Thiophenebutanenitrile,g-oxo- Customs Data
- HS CODE：2934999090
- Customs Data：
China Customs Code:
2934999090Overview:
2934999090. Other heterocyclic compounds. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%
Declaration elements:
Product Name, component content, use to
Summary:
2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
2-Thiophenebutanenitrile,g-oxo- Related Literature
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1. Estimating and correcting interference fringes in infrared spectra in infrared hyperspectral imagingGhazal Azarfar,Ebrahim Aboualizadeh,Nicholas M. Walter,Simona Ratti,Camilla Olivieri,Alessandra Norici,Michael Nasse,Achim Kohler,Mario Giordano Analyst, 2018,143, 4674-4683
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Goonay Yousefalizadeh,Shideh Ahmadi,Nicholas J. Mosey,Kevin G. Stamplecoskie Nanoscale, 2021,13, 242-252
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