Basic information
- CAS
1178487-43-8- Standard SMILES
OC1CC(c2cccc(Cl)c2)C1- InChIKey
XRENHEYMBXIJNW-UHFFFAOYSA-N- Molecular formula
- C10H11ClO
- Average molar mass
- 182.64 g/mol
- Monoisotopic mass
- 182.0498427
Names & identifiers
- Preferred name
- (1s,3s)-3-(3-Chlorophenyl)cyclobutan-1-ol
- IUPAC
- 3-(3-chlorophenyl)cyclobutan-1-ol
Names & synonyms
3-(3-chlorophenyl)cyclobutan-1-ol1178487-43-8152714-11-9(1S,3S)-3-(3-Chlorophenyl)cyclobutan-1-olRefChem:394121863-556-0980-485-13-(3-Chlorophenyl)cyclobutanolRel-(1s,3s)-3-(3-chlorophenyl)cyclobutan-1-ol3-(3-chlorophenyl)cyclobutan-1-ol, cisSCHEMBL20187570CGA71411
Show more names
MFCD12152573AKOS010008105SY035094EN300-115586EN300-216379
Database identifiers
- CAS
1178487-43-8、152714-11-9- PubChem CID
- 60792575
- EC Number
- 863-556-0、980-485-1
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 154
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, 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.
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Hazard information
Hazard Classes and Categories
Acute Tox. 4 (100%)
Skin Irrit. 2 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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