3-(Dimethylamino)propanoyl chloride hydrochloride
Basic information
- CAS
90801-02-8- Standard SMILES
CN(C)CCC(=O)Cl.Cl- InChIKey
LJQNMDZRCXJETK-UHFFFAOYSA-N- Molecular formula
- C5H11Cl2NO
- Average molar mass
- 172.05 g/mol
- Monoisotopic mass
- 171.0217694
Names & identifiers
- Preferred name
- 3-(Dimethylamino)propanoyl chloride hydrochloride
- IUPAC
- 3-(dimethylamino)propanoyl chloride;hydrochloride
- English name
- N,N-DimethylaminopropylchlorodeHcl
- Molecular formula
- C5H13Cl2N
- Molecular weight
- 158.06942
Names & synonyms
90801-02-83-(dimethylamino)propanoyl chloride hydrochlorideRefChem:495074818-357-3N,N-DimethylaminopropylchlorodeHcl3-(Dimethylamino)propanoyl chloride;hydrochlorideMFCD28505771SCHEMBL729304PEXGAXBFSROVLB-UHFFFAOYSA-N3-(dimethylamino)propanoylchloridehydrochlorideEN300-211078N,N-dimethyl-beta-alanyl chloride hydrochloride
Database identifiers
- CAS
90801-02-8- PubChem CID
- 19856532
- EC Number
- 818-357-3
Properties
Computed structural properties
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 82.5
Physicochemical properties
- Symbol(GHS)
- 5 · GHS05
- Signal word
- Danger
- Hazard statements
- 314 · H314
- Precautionary statements
- 260 · P260-P264-P280-P301+P330+P331-P303+P361+P353-P363-P304+P340-P310-P321-P305+P351+P338-P405-P501
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
H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 3 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Corr. 1B (100%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS05
- Hazard statements
- H314
- Precautionary statements
- P260-P264-P280-P301+P330+P331-P303+P361+P353-P363-P304+P340-P310-P321-P305+P351+P338-P405-P501
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…