Basic information
- CAS
23950-98-3- Standard SMILES
CCCC1CCC(O)C(OC)C1- InChIKey
FLNSLKJOWVMPEE-UHFFFAOYSA-N- Molecular formula
- C10H20O2
- Average molar mass
- 172.26 g/mol
- Monoisotopic mass
- 172.14632988
Names & identifiers
- Preferred name
- Cyclohexanol, 2-methoxy-4-propyl-
- IUPAC
- 2-methoxy-4-propylcyclohexan-1-ol
- English name
- 2-methoxy-4-propylcyclohexan-1-ol
- Molecular formula
- C10H20O2
- Molecular weight
- 172.26
Names & synonyms
2-Methoxy-4-propylcyclohexan-1-ol23950-98-32-Methoxy-4-propylcyclohexanolCyclohexanol, 2-methoxy-4-propyl-EINECS 245-953-5DTXSID30865124RefChem:580638DTXCID40813570245-953-5Cyclohexanol,2-methoxy-4-propyl-tarragolSCHEMBL1826822
Show more names
2-methoxy-4-propyl-cyclohexanolFLNSLKJOWVMPEE-UHFFFAOYSA-NYAA95098AKOS011043800cis-2-methoxy-cis-4-propylcyclohexanolNS00051383EN300-256507G59161
Database identifiers
- CAS
23950-98-3- PubChem CID
- 91098
- DTXSID
DTXSID30865124- EC Number
- 245-953-5
- Nikkaji
- J242.703F
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 125
Experimental & physicochemical properties
FragrancesFragrance Ingredient (Cyclohexanol, 2-methoxy-4-propyl-) -> IFRA transparency List
Physicochemical properties
- Boiling point
- 234 °C · 234 °C
- Density
- 0.95 · 0.95±0.1 g/cm3(Predicted)
- pka
- 14.68 · 14.68±0.60(Predicted)
- LogP
- 2.017 · 2.017 (est)
- EWG's Food Scores
- 1 · 1
- EPA Substance Registry System
- 2 · Cyclohexanol, 2-methoxy-4-propyl- (23950-98-3)
- Symbol(GHS)
- 7 · GHS07
- Hazard statements
- 315 · H315-H319
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
- TSCA
- TSCA listed
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
This chemical does not meet GHS hazard criteria for 63.1% (65 of 103) of all reports.
Warning
H315 (36.9%): 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 103 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
Chemical: Cyclohexanol, 2-methoxy-4-propyl-
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Hazard Classes and CategoriesSkin Irrit. 2 (36.9%)
Safety data
- tsca
- TSCA listed
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Uses & manufacturing
Use ClassificationFragrance Ingredients
General Manufacturing InformationCyclohexanol, 2-methoxy-4-propyl-: ACTIVE
Upstream & downstream products
Downstream products
Suppliers8 total
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
扬州瑞宏生物科技有限公司0514-015380367604 15380367604 · [email protected]
BOC Sciences[email protected]
陕西缔都医药化工有限公司029-81154043 17391733319 · [email protected]
河南天孚化工有限公司+86-0371-55170693 +86-19937530512 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
北京新研汇医药研发有限公司13969155946 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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