Basic information
- CAS
686746-12-3- Standard SMILES
CC(C)(N)CCCl.Cl- InChIKey
GOTDZEOIBMTRDU-UHFFFAOYSA-N- Molecular formula
- C5H13Cl2N
- Average molar mass
- 158.07 g/mol
Names & identifiers
- Preferred name
- 4-Chloro-2-methylbutan-2-amine hydrochloride
- IUPAC
- 4-chloro-2-methylbutan-2-amine;hydrochloride
Names & synonyms
686746-12-34-chloro-2-methylbutan-2-amine hydrochlorideRefChem:521138873-119-63-chloro-1,1-dimethylpropylamine-hydrochloride4-chloro-2-methylbutan-2-amine;hydrochloride4-chloro-2-methylbutan-2-aminehydrochlorideSCHEMBL853939GOTDZEOIBMTRDU-UHFFFAOYSA-NAKOS0063857323-chloro-1,1-dimethyl propylamine-hydrochlorideEN300-7591020
Database identifiers
- CAS
686746-12-3- PubChem CID
- 21094547
- EC Number
- 873-119-6
Properties
Computed structural properties
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 52
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Related reactions
2 records
Compound notes
Loading…