Cas no 37627-16-0 (1-Imidazolidinecarbonylchloride, 2-thioxo-)
37627-16-0 structure
Product Name:1-Imidazolidinecarbonylchloride, 2-thioxo-
CAS No:37627-16-0
MF:C4H5ClN2OS
MW:164.613298177719
CID:296979
PubChem ID:12900322
Update Time:2025-04-19
1-Imidazolidinecarbonylchloride, 2-thioxo- Chemical and Physical Properties
Names and Identifiers
-
- 1-Imidazolidinecarbonylchloride, 2-thioxo-
- 1-Imidazolidinecarbonyl chloride, 2-thioxo- (9CI)
- 2-sulfanylideneimidazolidine-1-carbonyl chloride
- 1-IMIDAZOLIDINECARBONYLCHLORIDE,2-THIOXO-
- 1-Chlorocarbonyl-imidazolidine-2-thione
- 1-IMIDAZOLIDINECARBONYL CHLORIDE, 2-THIOXO-
- DTXSID60512553
- SCHEMBL11685172
- 37627-16-0
- RUZNGTORRLNXHV-UHFFFAOYSA-N
- 2-sulfanyl-4,5-dihydro-1H-imidazole-1-carbonyl chloride
- EN300-1611757
-
- Inchi： 1S/C4H5ClN2OS/c5-3(8)7-2-1-6-4(7)9/h1-2H2,(H,6,9)
- InChI Key： RUZNGTORRLNXHV-UHFFFAOYSA-N
- SMILES： ClC(N1C(NCC1)=S)=O
Computed Properties
- Exact Mass: 163.98125
- Monoisotopic Mass: 163.9811117g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 9
- Rotatable Bond Count: 0
- Complexity: 161
- 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: 0.8
- Topological Polar Surface Area: 64.4?2
Experimental Properties
- PSA: 32.34
1-Imidazolidinecarbonylchloride, 2-thioxo- Related Literature
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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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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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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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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