Basic information
- Standard SMILES
Cl.NCCCS- InChIKey
GMEDUXHKSSWXSL-UHFFFAOYSA-N- Molecular formula
- C3H10ClNS
- Average molar mass
- 127.64 g/mol
- Monoisotopic mass
- 127.022248
Names & identifiers
- Preferred name
- (3-Mercaptopropyl)ammonium chloride
- IUPAC
- 3-aminopropane-1-thiol;hydrochloride
Names & synonyms
7211-54-3(3-Mercaptopropyl)ammonium chloride3-Amino-1-propanethiol hydrochlorideHomocysteamine hydrochloride3-Mercaptopropylamine hydrochloride1-Propanethiol, 3-amino-, hydrochlorideEINECS 230-593-3BD4K8XQ3LVNSC 69290Chlorhydrate de mercapto-3 propylamineChlorhydrate de mercapto-3 propylamine [French]NSC-69290
Show more names
RefChem:400300230-593-33-aminopropane-1-thiol hydrochloride3-aminopropane-1-thiol HCL3-aminopropane-1-thiol;hydrochlorideMFCD001374533-Aminopropane-1-thiol HClSCHEMBL2572827
Database identifiers
- CAS
7211-54-3- PubChem CID
- 197870
- DTXSID
DTXSID40992834- UNII
- BD4K8XQ3LV
- EC Number
- 230-593-3
Properties
Computed structural properties
- Topological polar surface area
- 27 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 16.4
Safety & regulation
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 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Related reactions
24 records
Linked notes
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