(E)-1-(2,6,6-trimethyl-1-cyclohexen-1-yl)pent-1-en-3-one

CAS 63429-28-7C14H22OMW 206.32

(E)-1-(2,6,6-trimethyl-1-cyclohexen-1-yl)pent-1-en-3-one (CAS 63429-28-7) — formula C14H22O, molecular weight 206.32; category organic chemicals.

Product Overview

CAS Number	63429-28-7
Molecular Formula	C14H22O
Molecular Weight	206.32
Boiling Point	102.00 °C. @ 2.60 mm Hg
LogP	3.4
Category	Organic Chemicals

Technical Profile

What this product is

(E)-1-(2,6,6-trimethyl-1-cyclohexen-1-yl)pent-1-en-3-one is a carbon-based organic compound with CAS registry number 63429-28-7 and molecular formula C14H22O (molecular weight 206.32), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 63429-28-7

Its molecular formula C14H22O comprises 14 C, 22 H, 1 O atoms.

Also known as: (E)-1-(2,6,6-trimethyl-1-cyclohexen-1-yl)pent-1-en-3-one · (E)-1-(2,6,6-三甲基-1-环己烯-1-基)戊-1-烯-3-酮

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of (E)-1-(2,6,6-trimethyl-1-cyclohexen-1-yl)pent-1-en-3-one?

The CAS registry number of (E)-1-(2,6,6-trimethyl-1-cyclohexen-1-yl)pent-1-en-3-one is 63429-28-7.

What is the molecular formula and molecular weight of (E)-1-(2,6,6-trimethyl-1-cyclohexen-1-yl)pent-1-en-3-one?

Molecular formula C14H22O, molecular weight 206.32.

What other names is (E)-1-(2,6,6-trimethyl-1-cyclohexen-1-yl)pent-1-en-3-one known by?

It is also registered under: (E)-1-(2,6,6-trimethyl-1-cyclohexen-1-yl)pent-1-en-3-one, (E)-1-(2,6,6-三甲基-1-环己烯-1-基)戊-1-烯-3-酮.

Which category does (E)-1-(2,6,6-trimethyl-1-cyclohexen-1-yl)pent-1-en-3-one belong to?

Category: Organic Chemicals.

PubChem Public Data

Independent reference data for (E)-1-(2,6,6-trimethyl-1-cyclohexen-1-yl)pent-1-en-3-one (CAS 63429-28-7), compiled from public chemistry databases.

Registry identifiers across databases

CAS 号	63429-28-7
PubChem CID	5375218
分子式	C14H22O
IUPAC 名称	(E)-1-(2,6,6-trimethylcyclohexen-1-yl)pent-1-en-3-one
UNII（FDA）	54PXU8D4R5
FEMA 编号	2712
JECFA 编号	399

Computed descriptors

Molecular Weight	206.32
XLogP3	3.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	3
Exact Mass	206.167065321
Monoisotopic Mass	206.167065321
Topological Polar Surface Area	17.1
Heavy Atom Count	15

Physicochemical values on record

Boiling Point	102.00 °C. @ 2.60 mm Hg
Boiling Point	238-242 °C
Density	0.930-0.935
Refractive Index	1.503-1.508

Synonyms and trade names

beta-Methylionone; beta-Iraldeine; beta methyl ionone; beta-Methyl ionone; Methyl-beta-ionone; .beta.-Methylionone; Methyl-.beta.-ionone; Cetone, beta-; 63429-28-7; beta-Ionone, methyl-; FEMA No. 2712; 1-PENTEN-3-ONE, 1-(2,6,6-TRIMETHYL-1-CYCLOHEXEN-1-YL)-; 54PXU8D4R5; (E)-1-(2,6,6-Trimethyl-1-cyclohexen-1-yl)pent-1-en-3-one; 5-(2,6,6-Trimethyl-1-cyclohexenyl)-4-penten-3-one; .BETA.-CETONE

Regulatory listings held on file

法规与食品接触	EU Flavoring substances FDA Substance added to food: FLAVOR ENHANCER, FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Floral No safety concern at current levels of intake when used as a flavouring agent

GHS hazard classification

已通报的危害声明	H315 (100%), H317 (100%), H411 (100%)

What the public record says

(E)-1-(2,6,6-三甲基-1-环己烯-1-基)戊-1-烯-3-酮 · CAS 63429-28-7 · C14H22O. UNII 54PXU8D4R5. Boiling Point: 102.00 °C. @ 2.60 mm Hg; Boiling Point: 238-242 °C; Density: 0.930-0.935.

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

(E)-1-(2,6,6-trimethyl-1-cyclohexen-1-yl)pent-1-en-3-one

Product Overview

Technical Profile

What this product is

Identification

Frequently Asked Questions

PubChem Public Data

Registry identifiers across databases

Computed descriptors

Physicochemical values on record

Synonyms and trade names

Regulatory listings held on file

GHS hazard classification

What the public record says

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