Cas no 329076-92-8 (1-Propanone, 2-chloro-1-(2-thienyl)- (9CI))
329076-92-8 structure
Product Name:1-Propanone, 2-chloro-1-(2-thienyl)- (9CI)
CAS No:329076-92-8
MF:C7H7ClOS
MW:174.647879838943
CID:1018071
PubChem ID:13143421
Update Time:2025-04-20
1-Propanone, 2-chloro-1-(2-thienyl)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- 1-Propanone, 2-chloro-1-(2-thienyl)- (9CI)
- 329076-92-8
- 2-CHLORO-1-(THIOPHEN-2-YL)PROPAN-1-ONE
- AKOS000155361
- 1-PROPANONE, 2-CHLORO-1-(2-THIENYL)-
- SCHEMBL6623068
- AKOS022231675
- DB-280296
-
- Inchi： 1S/C7H7ClOS/c1-5(8)7(9)6-3-2-4-10-6/h2-5H,1H3
- InChI Key： YBJIAOWXOCYNOV-UHFFFAOYSA-N
- SMILES： ClC(C)C(C1=CC=CS1)=O
Computed Properties
- Exact Mass: 173.9906137g/mol
- Monoisotopic Mass: 173.9906137g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 2
- Complexity: 138
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.3
- Topological Polar Surface Area: 45.3?2
1-Propanone, 2-chloro-1-(2-thienyl)- (9CI) Related Literature
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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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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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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