3-(1H-imidazol-1-yl)-2-methylpropanoic acid hydrochloride
Basic information
- CAS
1365836-85-6- Standard SMILES
CC(Cn1ccnc1)C(=O)O.Cl- InChIKey
GQAPFBYSZAHSJD-UHFFFAOYSA-N- Molecular formula
- C7H11ClN2O2
- Average molar mass
- 190.63 g/mol
- Monoisotopic mass
- 190.0509053
Names & identifiers
- Preferred name
- 3-(1H-imidazol-1-yl)-2-methylpropanoic acid hydrochloride
- IUPAC
- 3-imidazol-1-yl-2-methylpropanoic acid;hydrochloride
- English name
- CHEMCOLLECT KT001661
- Molecular formula
- C7H11ClN2O2
- Molecular weight
- 190.63
Names & synonyms
3-(1H-Imidazol-1-yl)-2-methylpropanoic acid hydrochloride1365836-85-6RefChem:489753981-176-43-imidazol-1-yl-2-methylpropanoic acid;hydrochlorideCHEMCOLLECT KT001661QEC83685MFCD25371524SY349618CS-0232477G42531EN300-1273012
Show more names
3-(1-Imidazolyl)-2-methylpropanoic Acid Hydrochloride3-imidazol-1-yl-2-methyl-propanoic acid;hydrochloride3-(1H-Imidazol-1-yl)-2-methylpropanoicacidhydrochlorideZ1431781034
Database identifiers
- CAS
1365836-85-6- PubChem CID
- 75360802
- EC Number
- 981-176-4
Properties
Computed structural properties
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 149
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%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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