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(1S)-(+)-NEOMENTHYL ACETATE

CAS 2552-91-2C12H22O2MW 198.30

(1S)-(+)-NEOMENTHYL ACETATE (CAS 2552-91-2) — formula C12H22O2, molecular weight 198.30; category organic chemicals.

Product Overview

CAS Number2552-91-2
Molecular FormulaC12H22O2
Molecular Weight198.30
Boiling Point227 °C
LogP3.6
CategoryOrganic Chemicals

Technical Profile

What this product is

(1S)-(+)-NEOMENTHYL ACETATE is a carbon-based organic compound with CAS registry number 2552-91-2 and molecular formula C12H22O2 (molecular weight 198.30), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 2552-91-2

Its molecular formula C12H22O2 comprises 12 C, 22 H, 2 O atoms.

Also known as: (1S)-(+)-NEOMENTHYL ACETATE · (1S)-(+)-乙酸新薄荷

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of (1S)-(+)-NEOMENTHYL ACETATE?

The CAS registry number of (1S)-(+)-NEOMENTHYL ACETATE is 2552-91-2.

What is the molecular formula and molecular weight of (1S)-(+)-NEOMENTHYL ACETATE?

Molecular formula C12H22O2, molecular weight 198.30.

What other names is (1S)-(+)-NEOMENTHYL ACETATE known by?

It is also registered under: (1S)-(+)-NEOMENTHYL ACETATE, (1S)-(+)-乙酸新薄荷.

Which category does (1S)-(+)-NEOMENTHYL ACETATE belong to?

Category: Organic Chemicals.

PubChem Public Data

Independent reference data for (1S)-(+)-NEOMENTHYL ACETATE (CAS 2552-91-2), compiled from public chemistry databases.

Registry identifiers across databases

CAS 号2552-91-2
PubChem CID27867
分子式C12H22O2
IUPAC 名称(5-methyl-2-propan-2-ylcyclohexyl) acetate
UNII(FDA)LF3LEI45OH
FEMA 编号2668
JECFA 编号431

Computed descriptors

Molecular Weight198.30
XLogP33.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass198.161979940
Monoisotopic Mass198.161979940
Topological Polar Surface Area26.3
Heavy Atom Count14

Physicochemical values on record

Boiling Point227 °C
Boiling Point227-228 °C
Densitydl-, (-)- 0.919-0.924
Vapor Pressure0.05 [mmHg]
Refractive Indexdl- 1.443-1.450; (-)- 1.443-1.447
Formulations/PreparationsGRADE: 95% MIN. /L-ISOMER/

Synonyms and trade names

Menthyl acetate; 16409-45-3; Menthol, acetate; Menthyl acetate racemic; Cyclohexanol, 5-methyl-2-(1-methylethyl)-, acetate; Acetic acid, p-menth-3-yl ester, dl-; DTXSID20859153; RefChem:1088940; DTXCID30210413; Cyclohexanol, 5-methyl-2-(1-methylethyl)-, acetate, (1alpha,2beta,5alpha)-; 201-911-8; 240-459-6; 249-409-8; LF3LEI45OH; 89-48-5; 2623-23-6

Regulatory listings held on file

法规与食品接触EU Flavoring substances
FDA Substance added to food: FLAVORING AGENT OR ADJUVANT
Flavoring Agents
FLAVOURING_AGENT: Flavouring Agent
Mint, Cool
No safety concern at current levels of intake when used as a flavouring agent
GHS 通报统计0.1% (1 / 1657)

GHS hazard classification

GHS 通报统计0.1% (1 / 1657)
已通报的危害声明H411

What the public record says

(1S)-(+)-乙酸新薄荷 · CAS 2552-91-2 · C12H22O2. UNII LF3LEI45OH. Boiling Point: 227 °C; Boiling Point: 227-228 °C; Density: dl-, (-)- 0.919-0.924.

Source: PubChem / Wikidata; the batch COA governs where values differ.

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