(But-3-yn-1-yl)(tert-butyl)methylamine hydrochloride
Basic information
- CAS
2193059-10-6- Standard SMILES
C#CCCN(C)C(C)(C)C.Cl- InChIKey
OXILPBOPGZDIBE-UHFFFAOYSA-N- Molecular formula
- C9H18ClN
- Average molar mass
- 175.7 g/mol
- Monoisotopic mass
- 175.1127773
Names & identifiers
- Preferred name
- (But-3-yn-1-yl)(tert-butyl)methylamine hydrochloride
- IUPAC
- N-but-3-ynyl-N,2-dimethylpropan-2-amine;hydrochloride
Names & synonyms
2193059-10-6(but-3-yn-1-yl)(tert-butyl)methylamine hydrochlorideRefChem:405959842-886-9N-But-3-ynyl-N,2-dimethylpropan-2-amine;hydrochlorideTMD05910AKOS034142020EN300-1698651Z30735436463-Butyn-1-amine, N-(1,1-dimethylethyl)-N-methyl-, hydrochloride (1:1)
Database identifiers
- CAS
2193059-10-6- PubChem CID
- 136574841
- EC Number
- 842-886-9
Properties
Computed structural properties
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 133
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)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
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Related reactions
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Compound notes
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