N-Ethyl-2-isopropyl-5-methylcyclohexane carboxamide

Name: N-Ethyl-2-isopropyl-5-methylcyclohexane carboxamide
Brand: Jinan Shenghe Chemical Co., Ltd.
SKU: 160474

CAS 39711-79-0C13H25NOMW 211.19 g/mol

N-Ethyl-2-isopropyl-5-methylcyclohexane carboxamide (CAS 39711-79-0) — formula C13H25NO, molecular weight 211.19 g/mol.

Specifications

CAS Number39711-79-0

Molecular FormulaC13H25NO

Molecular Weight211.19 g/mol

Melting Point91 - 93 °C

LogP3.5

ApplicationsUse Classification: Fragrance Ingredients, Flavoring Agents -> JECFA Flavorings Index, Cosmetics -> Tonic, General Manufacturing Information: Cyclohexanecarboxamide, N-ethyl-5-methyl-2-(1-methylethyl)-: ACTIVE

Where it is used

Documented applications: Use Classification: Fragrance Ingredients, Flavoring Agents -> JECFA Flavorings Index, Cosmetics -> Tonic, General Manufacturing Information: Cyclohexanecarboxamide, N-ethyl-5-methyl-2-(1-methylethyl)-: ACTIVE.

Purchase Profile

What this product is

N-Ethyl-2-isopropyl-5-methylcyclohexane carboxamide is a chemical compound with CAS registry number 39711-79-0 and molecular formula C13H25NO (molecular weight 211.19 g/mol).

Identification

CAS number: 39711-79-0

Its molecular formula C13H25NO comprises 13 C, 25 H, 1 N, 1 O atoms.

Also known as: N-Ethyl-2-isopropyl-5-methylcyclohexane carboxamide · N-ethyl-2-(isopropyl)-5-methylcyclohexanecarboxamide

Frequently Asked Questions

What is the CAS number of N-Ethyl-2-isopropyl-5-methylcyclohexane carboxamide?

The CAS registry number of N-Ethyl-2-isopropyl-5-methylcyclohexane carboxamide is 39711-79-0.

What is the molecular formula and molecular weight of N-Ethyl-2-isopropyl-5-methylcyclohexane carboxamide?

Molecular formula C13H25NO, molecular weight 211.19 g/mol.

What other names is N-Ethyl-2-isopropyl-5-methylcyclohexane carboxamide known by?

It is also registered under: N-Ethyl-2-isopropyl-5-methylcyclohexane carboxamide, N-ethyl-2-(isopropyl)-5-methylcyclohexanecarboxamide.

What are the documented applications of N-Ethyl-2-isopropyl-5-methylcyclohexane carboxamide?

Recorded applications: Use Classification: Fragrance Ingredients, Flavoring Agents -> JECFA Flavorings Index, Cosmetics -> Tonic, General Manufacturing Information: Cyclohexanecarboxamide, N-ethyl-5-methyl-2-(1-methylethyl)-: ACTIVE.

PubChem Public Data

Public-database records for N-Ethyl-2-isopropyl-5-methylcyclohexane carboxamide (CAS 39711-79-0), reproduced here for independent cross-checking.

Regulatory listings

Regulatory & Food Contact	EU Flavoring substances FDA Substance added to food: FLAVOR ENHANCER, FLAVORING AGENT OR ADJUVANT Flavoring Agents Mint, Cool

Physical description and handling notes

Solid
White solid; Slight menthol like cooling effect
Insoluble in water
Soluble (in ethanol)
152.7 Å² [M+H]+ [CCS Type: DT; Buffer gas: N2; Ionization: ESI+; Dataset: TOXCAST; Source Identifier: DTXSID5047039]
153.5 Å² [M+H]+ [CCS Type: DT; Buffer gas: N2; Ionization: APCI+; Dataset: TOXCAST; Source Identifier: DTXSID5047039]

Reported physical properties

熔点	91 - 93 °C

How this substance is indexed

CAS Registry Number	39711-79-0
PubChem CID	62907
分子式	C13H25NO
分子量	211.19 g/mol
IUPAC 名称	N-ethyl-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide
InChIKey	VUNOFAIHSALQQH-UHFFFAOYSA-N
UNII（FDA）	6S7S02945H
ChEBI 编号	CHEBI:168845
FEMA 编号	3455
JECFA 编号	1601

Documented uses

Flavoring Agents -> JECFA Flavorings Index
Cyclohexanecarboxamide, N-ethyl-5-methyl-2-(1-methylethyl)-: ACTIVE

Names this substance appears under

39711-79-0; N-Ethyl-p-menthane-3-carboxamide; N-Ethyl-2-isopropyl-5-methylcyclohexanecarboxamide; Ethyl menthane carboxamide; Cyclohexanecarboxamide, N-ethyl-5-methyl-2-(1-methylethyl)-; N-Ethyl-2-(isopropyl)-5-methylcyclohexanecarboxamide; DTXSID5047039; N-Ethyl-5-methyl-2-(1-methylethyl)cyclohexanecarboxamide; EINECS 254-599-0; 6S7S02945H; UNII-6S7S02945H; N-ethyl-5-methyl-2-(propan-2-yl)cyclohexane-1-carboxamide; DTXCID3027039; ETHYL MENTHANE CARBOXAMIDE [MI]; N-Ethyl-5-methyl-2-(1-methylethyl)-cyclohexane-carboxamide; ETHYL-2-ISOPROPYL-5-METHYLCYCLOHEXANE CARBOXAMIDE [FHFI]

Computed molecular descriptors

分子量	211.34
XLogP3	3.5
氢键供体数	1
氢键受体数	1
可旋转键数	3
精确质量	211.193614421
单同位素质量	211.193614421
拓扑极性表面积	29.1
重原子数	15
形式电荷	0

Database abstract

N-Ethyl-2-isopropyl-5-methylcyclohexane carboxamide is identified by CAS 39711-79-0, molecular formula C13H25NO and molecular weight 211.19 g/mol. UNII 6S7S02945H; ChEBI 168845; InChIKey VUNOFAIHSALQQH-UHFFFAOYSA-N. 熔点: 91 - 93 °C.

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

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