Basic information
- CAS
1185295-32-2- Standard SMILES
CC(C)c1ccc(CN2CCCC(C(=O)O)C2)cc1.Cl- InChIKey
SJOVAWIQZZQPSZ-UHFFFAOYSA-N- Molecular formula
- C16H24ClNO2
- Average molar mass
- 297.82 g/mol
- Monoisotopic mass
- 297.1495567
Names & identifiers
- Preferred name
- 1-(4-Isopropylbenzyl)piperidine-3-carboxylic acid hydrochloride
- IUPAC
- 1-[(4-propan-2-ylphenyl)methyl]piperidine-3-carboxylic acid;hydrochloride
- English name
- 1-(4-Isopropylbenzyl)piperidine-3-carboxylic acid hydrochloride
- Molecular formula
- C16H24ClNO2
- Molecular weight
- 297.82
Names & synonyms
1-(4-ISOPROPYLBENZYL)PIPERIDINE-3-CARBOXYLIC ACID HYDROCHLORIDE1185295-32-2C16H24ClNO21-[(4-propan-2-ylphenyl)methyl]piperidine-3-carboxylic acid;hydrochloride0238ADAKOS0158466051-(4-ISOPROPYLBENZYL)PIPERIDINE-3-CARBOXYLICACIDHYDROCHLORIDE1-{[4-(propan-2-yl)phenyl]methyl}piperidine-3-carboxylic acid hydrochloride
Database identifiers
- CAS
1185295-32-2- PubChem CID
- 45075005
Properties
Computed structural properties
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 295
Physicochemical properties
- Hazard Codes
- Xi
- HazardClass
- IRRITANT
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hazard_code
- Xi
- hazard_class
- IRRITANT
Chemistry & industry
Suppliers3 total
圣克鲁斯生物技术（上海）有限公司021-60936350 · [email protected]
爱必信（上海）生物科技有限公司021-38015121-8802 · [email protected]
MATRIX[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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