Cas no 223768-14-7 (2H-Imidazole-2-thione,1,3-dihydro-1-methyl-, radical ion(1+) (9CI))
223768-14-7 structure
Product Name:2H-Imidazole-2-thione,1,3-dihydro-1-methyl-, radical ion(1+) (9CI)
CAS No:223768-14-7
MF:C4H6N2S
MW:114.168838977814
CID:254445
PubChem ID:1349907
Update Time:2025-04-19
2H-Imidazole-2-thione,1,3-dihydro-1-methyl-, radical ion(1+) (9CI) Chemical and Physical Properties
Names and Identifiers
-
- 2H-Imidazole-2-thione,1,3-dihydro-1-methyl-, radical ion(1+) (9CI)
- 2-MERCAPTO-1-METHYLIMIDAZOLE
- 1,3-DIHYDRO-1-METHYL-2H-IMIDAZOL-2-THIONE
- 1-METHYL-1H-IMIDAZOLE-2-THIOL
- 1-METHYL-2-IMIDAZOLETHIOL
- 1-METHYL-2-MERCAPTOIMIDAZOLE
- METAZOLE
- METHIAZOLE
- METHIMAZOL
- TAPAZOLE
- AKOS000269708
- F0001-2396
- METHIMAZOLE [USP-RS]
- 1-Methylimidazole-2-thiol
- SPECTRUM1500396
- HMS1920L17
- Tox21_300532
- KBioGR_000515
- SW197088-3
- Methamazole
- Metotirin
- Spectrum5_000954
- BCP02147
- Thiamazole, European Pharmacopoeia (EP) Reference Standard
- SMR000058376
- THIAMAZOLE [EP MONOGRAPH]
- Tox21_110341_1
- Usaf el-30
- Metizol
- STR03572
- s1609
- NC00636
- Favistan
- THIAMAZOLE [WHO-DD]
- Q419663
- 223768-14-7
- Prestwick2_000786
- HY-B0208
- Metothyrine
- IDI1_000188
- NCGC00016273-02
- DB00763
- 2-Mercapto-1-methylimidazole, >=99%
- Prestwick0_000786
- SCHEMBL41647
- NCGC00094721-03
- METHIMAZOLE [IARC]
- HSDB 3361
- METHIMAZOLE (USP-RS)
- BS-3743
- Imidazole, 1-methyl-2-mercapto-
- NCGC00094721-06
- BSPBio_000892
- Thiamazol
- Methimazole (USP)
- Frentirox
- A832780
- 1-Metylo 2 merkaptoimidazolem [Polish]
- metimazolo
- 1-Methylimidazole-2(3H)-thione
- BDBM50241361
- NCGC00254307-01
- Thymidazole
- F1679-0258
- 2H-Imidazole-2-thione, 1,3-dihydro-1-methyl-
- NSC757111
- DivK1c_000188
- 1-METHYL-1H-IMIDAZOL-2-YLHYDROSULFIDE
- H03BB02
- NCGC00094721-04
- AB00443630-04
- SR-01000695434
- 2-Mercaptomethylimidazole
- 2-mecapto 1-methylimidazole
- Methimazole, United States Pharmacopeia (USP) Reference Standard
- Thacapzol
- 85916-84-3
- 554Z48XN5E
- METHIMAZOLE (IARC)
- DTXCID20820
- Tiamazolo [DCIT]
- 2-mercapto-N-methylimidazole
- 1-Methyl-2-mercapto imidazole
- Q-201364
- 1-Methyl-1H-imidazole-2(3H)-thione
- MLS002548853
- Prestwick_1010
- NSC38608
- Spectrum3_000495
- HMS3714M14
- NCGC00178875-01
- 2H-Imidazole-2-thione,3-dihydro-1-methyl-
- N-Methyl-2-mercaptoimidazole
- Spectrum2_001273
- Methimazole-d3(methyl-d3)
- Tiamazol
- NS00009257
- HMS500J10
- Mercazolylum
- CCG-39656
- Merkastan
- Metazolo
- WLN: T5N CNJ A BSH
- Methimazole, VETRANAL(TM), analytical standard
- HMS2094C05
- GTPL6649
- methimazole
- 1-methylimidazole-2-thione
- Tox21_201341
- NCGC00094721-05
- Metothyrin
- thiamazole
- 4-Imidazoline-2-thione, 1-methyl-
- NSC 38608
- NINDS_000188
- Mercazolyl
- Basolan
- Thiamazol [INN-French]
- MFCD00179321
- 2-Mercapto-1-methylimidazol
- Methimazol 100 microg/mL in Acetonitrile
- Tapazole (TN)
- Methiamazole
- 60-56-0
- Spectrum4_000048
- 2-mercapto-1-methyl-imidazole
- AI3-60285
- KBio2_004043
- Thycapzol
- HMS2097M14
- KBio3_001489
- AB00443630_07
- Methymazol
- 1-Metylo 2 merkaptoimidazolem
- SBI-0206922.P001
- HMS3651I13
- 2-mercapto-3-methylimidazole
- 1-METHYL-1,3-DIHYDRO-2H-IMIDAZOLE-2-THIONE
- M0868
- NCGC00094721-07
- H10722
- Tiamazol [INN-Spanish]
- tiamazole
- Thiamazole,(S)
- AC-785
- Tiamazolo
- CHEBI:50673
- CHEMBL1515
- Prestwick3_000786
- SBI-0206922.P004
- 1-Methyl-1H-imidazole-2-thiol #
- METHIMAZOLE (USP MONOGRAPH)
- Felimazole
- HMS2091D12
- NSC-38608
- Methylmercaptoimidazole
- FT-0603253
- Thiamazolum [INN-Latin]
- Mercaptazole
- EN300-18327
- AB00443630-03
- BIDD:GT0163
- KBioSS_001475
- THIAMAZOLE (EP MONOGRAPH)
- AKOS000119427
- Metimazol
- SPBio_001266
- Strumazol
- Thiamazol (INN-French)
- Merkazolil
- SR-01000695434-2
- 1-methyl-1-H-imidazole-2-thiol
- AMY11202
- Prestwick1_000786
- Methimazole (Tapazole, Northyx)
- SR-05000001672-1
- UNII-554Z48XN5E
- D00401
- NCGC00094721-01
- Methimazole, analytical standard
- Tiamazol (INN-Spanish)
- SR-05000001672
- CAS-60-56-0
- 2-Mercapto-1-methyl-1H-imidazole
- Thimazole
- Tox21_110341
- Tapuzole
- NCGC00016273-01
- Thiamazolum (INN-Latin)
- BSPBio_001989
- BPBio1_000982
- KBio2_006611
- AB00443630_06
- Methimazole [USP]
- Spectrum_000995
- Mercasolyl
- Thiamazole (JP17/INN)
- NSC-757111
- N-methyl imidazole-2-thiol
- MMZ
- Pharmakon1600-01500396
- KBio2_001475
- Thiamazolum
- 1-methyl-1H-immidazole-2-thiol
- KBio1_000188
- CCG-220786
- NCGC00258893-01
- SR-05000001672-2
- 1-methyl-3H-imidazole-2-thione
- 1-methyl-2-mercapto-imidazole
- EINECS 200-482-4
- Thimazol
- THIAMAZOLE [MART.]
- 3-methyl-1H-imidazole-2-thione
- Imidazole-2-thiol, 1-methyl-
- METHIMAZOLE [VANDF]
- Mercaptizole
- THIAMAZOLE (MART.)
- SPBio_002831
- Mercazole
- C07190
- BRD-K54416256-001-15-7
- Z57901905
- 1-Methyl-imidazole-2-thiol
- METHIMAZOLE [ORANGE BOOK]
- HMS1570M14
- THIAMAZOLE [JAN]
- 1-Methyl-1,3-dihydroimidazole-2-thione
- HMS3259L09
- NCGC00094721-02
- NCGC00016273-03
- Strumazole
- HMS2090B17
- Methimazolum
- METHIMAZOLE [USP MONOGRAPH]
- MLS000028413
- DTXSID4020820
- METHIMAZOLE [MI]
- Imidazole-2-thio, 1-methyl-
- 1,3-Dihydro-1-methyl-2H-imidazole-2-thione
- Thymidazol
- Thiamazole [INN]
- METHIMAZOLE [HSDB]
- 1-methyl-2,3-dihydro-1H-imidazole-2-thione
- Thycapsol
- Danantizol
-
- Inchi: 1S/C4H6N2S/c1-6-3-2-5-4(6)7/h2-3H,1H3,(H,5,7)
- InChI Key: PMRYVIKBURPHAH-UHFFFAOYSA-N
- SMILES: S=C1NC=CN1C
Computed Properties
- Exact Mass: 114.02500
- Monoisotopic Mass: 114.02516937g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 7
- Rotatable Bond Count: 0
- Complexity: 119
- 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: 47.4?2
Experimental Properties
- Melting Point: 144-147?°C(lit.)
- Boiling Point: 280.0 °C
- PSA: 52.81000
- LogP: 1.08270
2H-Imidazole-2-thione,1,3-dihydro-1-methyl-, radical ion(1+) (9CI) Security Information
- WGK Germany:3
- Hazard Category Code: 43-62-63
- Safety Instruction: 26-27-36-45
- RTECS:NI8615000
-
Hazardous Material Identification:
- Storage Condition:2-8°C
2H-Imidazole-2-thione,1,3-dihydro-1-methyl-, radical ion(1+) (9CI) Related Literature
-
Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
-
Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
-
Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
-
Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
-
Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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