Basic information
- CAS
2402838-86-0- Standard SMILES
COCC1C=CCCN1.Cl- InChIKey
XIHATQQTZQQGFG-UHFFFAOYSA-N- Molecular formula
- C7H14ClNO
- Average molar mass
- 163.64 g/mol
- Monoisotopic mass
- 163.0763918
Names & identifiers
- Preferred name
- 6-(Methoxymethyl)-1,2,3,6-tetrahydropyridine hydrochloride
- IUPAC
- 6-(methoxymethyl)-1,2,3,6-tetrahydropyridine;hydrochloride
Names & synonyms
2402838-86-06-(methoxymethyl)-1,2,3,6-tetrahydropyridine hydrochlorideRefChem:539763100-707-56-(Methoxymethyl)-1,2,3,6-tetrahydropyridine;hydrochlorideEN300-7466381Z4080639654
Database identifiers
- CAS
2402838-86-0- PubChem CID
- 145908099
- EC Number
- 100-707-5
Properties
Computed structural properties
- Topological polar surface area
- 21.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 101
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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