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DL-ISOMENTHOL

DL-ISOMENTHOL structure

CAS No:
3623-52-7
Formula:
C10H20O
Chemical Name:
DL-ISOMENTHOL
Synonyms:
ISOMENTHOL, DL-;DL-ISOMENTHOL;5-methyl-2-(1-methylethyl)-,(1-alpha,2-beta,5-beta)-(+-)-cyclohexano;5-methyl-2-(1-methylethyl)-,(1alpha,2beta,5beta)-(+/-)-cyclohexano;cis-1,3-cis-1,4-(+-)-mentho;ISOMENTHOL, DL-(SG);(1R,2R,5R)-5-methyl-2-propan-2-yl-cyclohexan-1-ol;(1R,2R,5R)-5-methyl-2-propan-2-ylcyclohexan-1-ol

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Description

Liquid

Solid|Solid/cool minty aroma

ChEBI: Neoisomenthol is a p-menthan-3-ol.

DL-ISOMENTHOL Basic Attributes

Molecular Weight：

156.27

Exact Mass：

156.27

EC Number：

222-825-7

UNII：

Y73A3UB774

TSCA：

TSCA listed

HScode：

2906110000

Characteristics

PSA：

20.23000

XLogP3：

2.43950

Appearance：

D,l-menthol is a white crystalline solid with a peppermint odor and taste. (NTP, 1992)

Density：

0.890±0.06 g/cm3(Predicted)

Melting Point：

53-54°C

Boiling Point：

218°C

Flash Point：

93.3ºC

Refractive Index：

1.457

Water Solubility：

Very soluble in alcohol, chloroform, ether, petroleum ether, solvent hexane; freely soluble in glacial acetic acid, liquid petrolatum and in mineral, fixed and volatile oils /dl-Menthol/

Storage Conditions：

Keep container tightly closed in a dry and well-ventilated place.

Vapor Pressure：

7.67X10-3 mm Hg at 25 deg C (est)

Vapor Density：

5.4 (NTP, 1992) (Relative to Air)

Specific rotation：

Specific optical rotation: +2.2 deg at 15 °C/D (alcohol solution)

Odor：

at 10.00 % in propylene glycol. mentholic musty woody camphoreous

Taste：

Peppermint taste /dl-Menthol/

PKA：

15.30±0.60(Predicted)

Safety Information

safety instructions：

24/25

Stability/Shelf Life：

Stable under recommended storage conditions.

Precautionary statement(s)：

P264, P280, P302+P352, P321, P332+P313, P362

Hazard Statements：

H315

GHS Classification：

|Warning|H315 (98.61%): Causes skin irritation [Warning Skin corrosion/irritation]|P264, P280, P302+P352, P321, P332+P313, and P362|Aggregated GHS information provided by 72 companies from 2 notifications to the ECHA C&L Inventory.

Drug Information

MeSH Entry Terms：

isomenthol

DL-ISOMENTHOL Use and Manufacturing

Manufacturing Info：

Cyclohexanol, 5-methyl-2-(1-methylethyl)-, (1R,2S,5S)-rel-: ACTIVE

Use Classification：

Flavouring Agent -> FLAVOURING_AGENT; -> JECFA Functional Classes|Flavoring Agents -> JECFA Flavorings Index

Food Additive Classes：

Flavouring Agent -> FLAVOURING_AGENT;|Flavoring Agents

Computed Properties

Molecular Weight:156.26
XLogP3:3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:156.151415257
Monoisotopic Mass:156.151415257
Topological Polar Surface Area:20.2
Heavy Atom Count:11
Complexity:120
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of DL-ISOMENTHOL

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Use and Manufacturing
Computed Properties

DL-ISOMENTHOL

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