4-(4-Hydroxy-4-methylpentyl)cyclohex-3-enecarbaldehyde

Modify Date: 2025-08-26 11:15:40

4-(4-Hydroxy-4-methylpentyl)cyclohex-3-enecarbaldehyde structure	Common Name	4-(4-Hydroxy-4-methylpentyl)cyclohex-3-enecarbaldehyde
	CAS Number	31906-04-4	Molecular Weight	210.313
	Density	1.0±0.1 g/cm3	Boiling Point	318.7±42.0 °C at 760 mmHg
	Molecular Formula	C₁₃H₂₂O₂	Melting Point	N/A
	MSDS	Chinese USA	Flash Point	135.1±20.5 °C

Name	4-(4-hydroxy-4-methylpentyl)cyclohex-3-ene-1-carbaldehyde
Synonym	More Synonyms

Density	1.0±0.1 g/cm3
Boiling Point	318.7±42.0 °C at 760 mmHg
Molecular Formula	C₁₃H₂₂O₂
Molecular Weight	210.313
Flash Point	135.1±20.5 °C
Exact Mass	210.161987
PSA	37.30000
LogP	2.53
Vapour Pressure	0.0±1.5 mmHg at 25°C
Index of Refraction	1.528
Storage condition	2-8°C

MSDS(Chinese)

CHEMICAL IDENTIFICATION

RTECS NUMBER :: GW2850000

CHEMICAL NAME :: 3-Cyclohexene-1-carboxaldehyde, 4-(4-hydroxy-4-methylpentyl)-

CAS REGISTRY NUMBER :: 31906-04-4

LAST UPDATED :: 199712

DATA ITEMS CITED :: 7

MOLECULAR FORMULA :: C13-H22-O2

MOLECULAR WEIGHT :: 210.35

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: Standard Draize test

ROUTE OF EXPOSURE :: Administration onto the skin

SPECIES OBSERVED :: Rodent - rabbit

REFERENCE :: NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: OTS0535072

TYPE OF TEST :: Standard Draize test

ROUTE OF EXPOSURE :: Administration into the eye

SPECIES OBSERVED :: Rodent - rabbit

REFERENCE :: FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 30,49S,1992 ** ACUTE TOXICITY DATA **

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 3250 uL/kg

TOXIC EFFECTS :: Sense Organs and Special Senses (Eye) - lacrimation Behavioral - somnolence (general depressed activity) Behavioral - tremor

REFERENCE :: NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: OTS0535072

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Administration onto the skin

SPECIES OBSERVED :: Rodent - rabbit

DOSE/DURATION :: 11300 uL/kg

TOXIC EFFECTS :: Behavioral - somnolence (general depressed activity) Gastrointestinal - changes in structure or function of salivary glands

REFERENCE :: NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: OTS0535072

Personal Protective Equipment	Eyeshields;Gloves
Hazard Codes	Xi
RIDADR	NONH for all modes of transport
WGK Germany	2
RTECS	GW2850000
HS Code	2912491000

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myrcenol

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acrolein

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~92%

4-(4-Hydroxy-4-...

CAS#:31906-04-4

Literature: Kumobayashi, Hidenori; Mitsuhashi, Shigeru; Akutagawa, Susumu; Ohtsuka, Sei Chemistry Letters, 1986 , p. 157 - 160

(E)-N,N-diethyl...

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Literature: Chemistry Letters, , p. 157 - 160

Precursor 4
CAS#:40267-53-6 (2E)-N,N-diethy... CAS#:543-39-5 myrcenol CAS#:107-02-8 acrolein CAS#:68759-12-6 (E)-N,N-diethyl...
DownStream 0

HS Code	2912491000
Summary	2912491000. other aldehyde-alcohols. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0%

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Experimental elicitation with hydroxyisohexyl-3-cyclohexene carboxaldehyde-containing deodorants.

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Hydroxyisohexyl-3-cyclohexene carboxaldehyde (HICC) known as Lyral is a frequent allergen. It is used in more than 50% of marketed deodorants. The aim of the present study was to determine elicitation...

MFCD00019423

4-(4-Hydroxy-4-methylpentyl)-3-cyclohexene-1-carboxaldehyde

4-(4-Hydroxy-4-methylpentyl)cyclohex-3-enecarbaldehyde

4-(4-hydroxy-4-methylpentyl)-cyclohex-3-ene-1-carbaldehyde

Hydroxymethylpentylcyclohexenecarboxaldehyde

3-Cyclohexene-1-carboxaldehyde, 4-(4-hydroxy-4-methylpentyl)-

4-(4-Hydroxy-4-methylpentyl)-1-cyclohex-3-enecarboxaldehyde

4-(4-hydroxy-4-methylpentyl)-3-cyclohexenecarboxaldehyde

Landolal

Kovanol

Lyral

4-(4-Hydroxy-4-methylpentyl)-3-cyclohexene-1-carbaldehyde

3-Cyclohexene-1-carboxaldehyde,4-(4-hydroxy-4-methylpentyl)

4-(4'-hydroxy-4'-methylpentyl)-3-cyclohexene carbaldehyde

EINECS 250-863-4

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4-(4-Hydroxy-4-methylpentyl)cyclohex-3-enecarbaldehyde

Names

Chemical & Physical Properties

MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

Safety Information

Synthetic Route

Precursor & DownStream

Customs

Articles28

Synonyms

The content on this webpage is sourced from various professional data sources. If you have any questions or concerns regarding the content, please feel free to contact service1@chemsrc.com.