Cas no 663612-79-1 (Hydrazinecarbothioamide, 2-(thioxomethyl)-)
663612-79-1 structure
Product Name:Hydrazinecarbothioamide, 2-(thioxomethyl)-
CAS No:663612-79-1
MF:C2H5N3S2
MW:135.211196660995
CID:1708794
PubChem ID:71375086
Update Time:2025-04-21
Hydrazinecarbothioamide, 2-(thioxomethyl)- Chemical and Physical Properties
Names and Identifiers
-
- Hydrazinecarbothioamide, 2-(thioxomethyl)-
- N-(carbamothioylamino)methanethioamide
- 663612-79-1
- DTXSID70797839
- 2-Methanethioylhydrazine-1-carbothioamide
-
- Inchi： 1S/C2H5N3S2/c3-2(7)5-4-1-6/h1H,(H,4,6)(H3,3,5,7)
- InChI Key： UCJMZCDJJKNDTA-UHFFFAOYSA-N
- SMILES： S=C(N)NNC=S
Computed Properties
- Exact Mass: 134.99265
- Monoisotopic Mass: 134.99248952g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 7
- Rotatable Bond Count: 0
- Complexity: 81
- 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: -0.3
- Topological Polar Surface Area: 114?2
Experimental Properties
- PSA: 50.08
Hydrazinecarbothioamide, 2-(thioxomethyl)- Related Literature
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Gerald J. Meyer,Leif Hammarstr?m Chem. Sci., 2020,11, 3460-3473
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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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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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