Basic information
- CAS
4573-50-6- Standard SMILES
CC1=CC(=O)[C@@H](C(C)C)CC1- InChIKey
YSTPAHQEHQSRJD-SECBINFHSA-N- Molecular formula
- C10H16O
- Average molar mass
- 152.23 g/mol
- Monoisotopic mass
- 152.12011513
Overview
(-)-piperitone is a piperitone. It is an enantiomer of a (+)-piperitone.
Names & identifiers
- Preferred name
- Piperitone, L-
- IUPAC
- (6R)-3-methyl-6-propan-2-ylcyclohex-2-en-1-one
- English name
- (R)-6-(isopropyl)-3-methylcyclohex-2-en-1-one
- Molecular formula
- C10H16O
- Molecular weight
- 152.23
Names & synonyms
l-piperitone4573-50-6(-)-piperitonePiperitone, L-(R)-6-(Isopropyl)-3-methylcyclohex-2-en-1-one2-Cyclohexen-1-one, 3-methyl-6-(1-methylethyl)-, (6R)-8GZY0Q0N20FEMA NO. 4200FEMA NO. 2910, L-EINECS 224-957-0L-PIPERITONE [FHFI]CHEBI:48934
Show more names
(±)-Piperitonelaevo-piperitone(R)-(-)-PiperitoneL-PIPERITONE, NATURALL-PIPERITONE, SYNTHETIC(R)-6-Isopropyl-3-methyl-2-cyclohexen-1-one
DTXSID10884090(6R)-6-isopropyl-3-methylcyclohex-2-en-1-one(6R)-3-methyl-6-(1-methylethyl)-2-cyclohexen-1-oneRefChem:863610DTXCID001023560224-957-0(R)-6-Isopropyl-3-methylcyclohex-2-en-1-one(6R)-3-methyl-6-propan-2-ylcyclohex-2-en-1-one
Database identifiers
- CAS
4573-50-6- PubChem CID
- 107561
- DTXSID
DTXSID10884090- ChEMBL
CHEMBL2229207
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 189
Experimental & physicochemical properties
SpringerMaterials PropertiesDensity
FragrancesFragrance Ingredient (l-Piperitone) -> IFRA transparency List
Food AdditivesFLAVORING AGENT OR ADJUVANT -> FDA Substance added to food
Density0.929-0.934
Flavoring AgentsEU Flavoring substances
Solubility
Insoluble in water
Soluble (in ethanol)
Boiling Point233-235 °C
Refractive Index1.483-1.487
Physical DescriptionLight yellowish liquid; Herbaceous minty aroma
Physicochemical properties
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 28.1% (390 of 1388) of reports.
Warning
H315 (71.9%): Causes skin irritation [Warning Skin corrosion/irritation]
P264, P280, P302+P352, P321, P332+P317, and P362+P364 (click each P-code to see the statement)
Aggregated GHS information provided per 1388 reports by companies from 5 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory Information
Chemical: 2-Cyclohexen-1-one, 3-methyl-6-(1-methylethyl)-, (R)-
Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)
REACH registered substance: (R)-6-(isopropyl)-3-methylcyclohex-2-en-1-one (EC: 224-957-0)
Hazard Classes and CategoriesSkin Irrit. 2 (71.9%)
Safety data
- wgk
- WGK 3
- tsca
- TSCA listed
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Storage Class
- 10 - Combustible liquids
- Hazard statements
- H319-H315-H317
- REACH Registrations
- Active
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2Skin Sens. 1
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Uses & manufacturing
Use Classification
Fragrance Ingredients
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
Flavoring Agents -> JECFA Flavorings Index
General Manufacturing Information2-Cyclohexen-1-one, 3-methyl-6-(1-methylethyl)-, (6R)-: ACTIVE
Suppliers10 total
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
深圳菲斯生物科技有限公司0755-83725350 13380397412 · [email protected]
九鼎化学（上海）科技有限公司4009209199 · [email protected]
BOC Sciences[email protected]
深圳聚合生化科技有限公司+86-400-002-6226 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 18651614124 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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