2-(Diethylamino)ethyl carbamimidothioate--hydrogen chloride (1/2)
Basic information
- CAS
17124-73-1- Standard SMILES
CCN(CC)CCSC(=N)N.Cl.Cl- InChIKey
QMSYVGCCVPYKCT-UHFFFAOYSA-N- Molecular formula
- C7H19Cl2N3S
- Average molar mass
- 248.22 g/mol
- Monoisotopic mass
- 247.0676742
Names & identifiers
- Preferred name
- 2-(Diethylamino)ethyl carbamimidothioate--hydrogen chloride (1/2)
- IUPAC
- 2-(diethylamino)ethyl carbamimidothioate;dihydrochloride
Names & synonyms
DTXSID409379472-(Diethylamino)ethyl carbamimidothioate--hydrogen chloride (1/2)RefChem:1061700DTXCID20136649717124-73-12-Diethylaminoethylisothiuronium chloride hydrochlorideEINECS 241-187-02-(2-(Diethylammonio)ethyl)isothiouronium dichloride2-(2-(Diethylamino)ethyl)-2-thiopseudourea dihydrochlorideQMSYVGCCVPYKCT-UHFFFAOYSA-NPseudourea, 2-(2-(diethylamino)ethyl)-2-thio-, dihydrochloride
Database identifiers
- CAS
17124-73-1- PubChem CID
- 86960
- DTXSID
DTXSID40937947- EC Number
- 241-187-0
Properties
Computed structural properties
- Topological polar surface area
- 78.4 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 112
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…