Basic information
- CAS
2547-92-4- Standard SMILES
C=CCSC(=N)N.Cl- InChIKey
FOPNKOONSKRMAQ-UHFFFAOYSA-N- Molecular formula
- C4H9ClN2S
- Average molar mass
- 152.65 g/mol
- Monoisotopic mass
- 152.0174972
Names & identifiers
- Preferred name
- Carbamimidothioic acid, 2-propen-1-yl ester, hydrochloride (1:1)
- IUPAC
- prop-2-enyl carbamimidothioate;hydrochloride
Names & synonyms
Carbamimidothioic acid, 2-propenyl ester, monohydrochlorideDTXSID5062508Carbamimidothioic acid, 2-propen-1-yl ester, hydrochloride (1:1)RefChem:123438DTXCID60373082547-92-4SCHEMBL6751549FOPNKOONSKRMAQ-UHFFFAOYSA-Nallyl carbamimidothioate hydrochlorideProp-2-en-1-yl carbamimidothioate--hydrogen chloride (1/1)
Database identifiers
- CAS
2547-92-4- PubChem CID
- 75686
- DTXSID
DTXSID5062508
Properties
Computed structural properties
- Topological polar surface area
- 75.2 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 79.8
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationCarbamimidothioic acid, 2-propen-1-yl ester, hydrochloride (1:1): INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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