4-Methanesulfinylbutan-2-amine hydrochloride
Basic information
- CAS
1354950-26-7- Standard SMILES
CC(N)CCS(C)=O.Cl- InChIKey
SWWJILQNFPJGDR-UHFFFAOYSA-N- Molecular formula
- C5H14ClNOS
- Average molar mass
- 171.69 g/mol
- Monoisotopic mass
- 171.0484629
Names & identifiers
- Preferred name
- 4-Methanesulfinylbutan-2-amine hydrochloride
- IUPAC
- 4-methylsulfinylbutan-2-amine;hydrochloride
Names & synonyms
4-methanesulfinylbutan-2-amine hydrochloride1354950-26-7RefChem:524413894-714-7AKOS0267453364-methanesulfinylbutan-2-aminehydrochloride4-methylsulfinylbutan-2-amine;hydrochlorideEN300-90393Z1269750451
Database identifiers
- CAS
1354950-26-7- PubChem CID
- 54595490
- EC Number
- 894-714-7
Properties
Computed structural properties
- Topological polar surface area
- 62.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 84.5
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
Danger
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+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%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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