Basic information
- CAS
2445792-67-4- Standard SMILES
Cc1cccc(C2(O)CNC2)c1.Cl- InChIKey
URUCWUTWHHIPKT-UHFFFAOYSA-N- Molecular formula
- C10H14ClNO
- Average molar mass
- 199.68 g/mol
- Monoisotopic mass
- 199.0763918
Names & identifiers
- Preferred name
- 3-(3-Methylphenyl)azetidin-3-ol hydrochloride
- IUPAC
- 3-(3-methylphenyl)azetidin-3-ol;hydrochloride
Names & synonyms
2445792-67-43-(3-methylphenyl)azetidin-3-ol hydrochlorideRefChem:492160102-413-23-(3-Methylphenyl)azetidin-3-ol;hydrochloride3-(3-methylphenyl)azetidin-3-olhydrochlorideEN300-26979930
Database identifiers
- CAS
2445792-67-4- PubChem CID
- 155821189
- EC Number
- 102-413-2
Properties
Computed structural properties
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 165
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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