Basic information
- CAS
491-01-0- Standard SMILES
CC(C)[C@H]1CC[C@@H](C)CC1O- InChIKey
NOOLISFMXDJSKH-MGRQHWMJSA-N- Molecular formula
- C10H20O
- Average molar mass
- 156.26 g/mol
Overview
neomenthol has been reported in Clinopodium thymifolium with data available.
Names & identifiers
- Preferred name
- Npc168552
- IUPAC
- cis-(2R,5R)-5-methyl-2-propan-2-ylcyclohexan-1-ol
Names & synonyms
RefChem:1092767Npc168552Neomenthol(2R,5R)-5-methyl-2-propan-2-ylcyclohexan-1-olSCHEMBL2028043
Database identifiers
- CAS
491-01-0- PubChem CID
- 19243
- EC Number
- 207-723-2
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 120
Safety & regulation
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)
Aggregated GHS information provided per 114 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Related reactions
1 records
Compound notes
Loading…