Basic information
- CAS
20167-22-0- Standard SMILES
Cl.Cl.N=C(N)SCc1csc(N)n1- InChIKey
WIXIDRZYQYPNGN-UHFFFAOYSA-N- Molecular formula
- C5H10Cl2N4S2
- Average molar mass
- 261.2 g/mol
- Monoisotopic mass
- 259.9723941
Names & identifiers
- Preferred name
- (2-Amino-1,3-thiazol-4-YL)methyl imidothiocarbamate dihydrochloride
- IUPAC
- (2-amino-1,3-thiazol-4-yl)methyl carbamimidothioate;dihydrochloride
- English name
- {[(2-amino-1,3-thiazol-4-yl)methyl]sulfanyl}methanimidamide dihydrochloride
- Molecular formula
- C5H10Cl2N4S2
- Molecular weight
- 261.1957
Names & synonyms
(2-AMINO-1,3-THIAZOL-4-YL)METHYL IMIDOTHIOCARBAMATE DIHYDROCHLORIDERefChem:395230657-145-320167-22-0AG 3072-((2-Amino-4-tiazolyl)methyl)isothiouronium dichloride{[(2-amino-1,3-thiazol-4-yl)methyl]sulfanyl}methanimidamide dihydrochloridePseudourea, 2-((2-amino-4-thiazolyl)methyl)-2-thio-, dihydrochloride(2-Aminothiazol-4-yl)methyl carbamimidothioate dihydrochlorideUSAF A-1149NSC 83548Carbamimidothioic acid, (2-amino-4-thiazolyl)methyl ester, dihydrochloride
Show more names
Pseudourea, 2-thio-, 4-(2-aminothiazolyl)methyl-, dichlorideorb1698702SCHEMBL11171970WIXIDRZYQYPNGN-UHFFFAOYSA-NDTXSID601374549HMS1536J21AKOS024275463ST012287
Database identifiers
- CAS
20167-22-0- PubChem CID
- 73232
Properties
Computed structural properties
- Topological polar surface area
- 142 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 151
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
- Toxicity
- 50 ipr-mus: · LD50 ipr-mus: 200 mg/kg NTIS** AD277-689
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- Toxicity
- LD50 ipr-mus: 200 mg/kg NTIS** AD277-689
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers5 total
北京百奥创新科技有限公司15522676233 · [email protected]
深圳振强药物研发有限公司0755-66853366 13670046396 · [email protected]
郑州艾克姆化工有限公司037163312495 13303845143 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
Related reactions
1 records
Compound notes
Loading…