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Substance Name: Hydroxyisohexyl 3-cyclohexene carboxaldehyde
RN: 31906-04-4
UNII: QUE43B9Z2Q
InChIKey: ORMHZBNNECIKOH-UHFFFAOYSA-N
Classification Code
- Skin / Eye Irritant
Molecular Formula
- C13-H22-O2
Molecular Weight
- 210.3148
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Names and Synonyms
Name of Substance
- Hydroxyisohexyl 3-cyclohexene carboxaldehyde
Synonyms
- 4-(4-Hydroxy-4-methylpentyl)-3-cyclohexene-1-carboxaldehyde
- BRN 2046455
- EINECS 250-863-4
- Liral
- Lyral
- UNII-QUE43B9Z2Q
Systematic Names
- 3-Cyclohexene-1-carboxaldehyde, 4-(4-hydroxy-4-methylpentyl)-
- 4-(4-Hydroxy-4-methylpentyl)cyclohex-3-enecarbaldehyde
Superlist Name
- 3-Cyclohexene-1-carboxaldehyde, 4-(4-hydroxy-4-methylpentyl)-
Registry Numbers
CAS Registry Number
- 31906-04-4
FDA UNII
- QUE43B9Z2Q
Other Registry Numbers
- 1384450-22-9
- 56493-02-8
- 80449-98-5
System Generated Number
- 0031906044
Structure Descriptors
InChI
InChI=1S/C13H22O2/c1-13(2,15)9-3-4-11-5-7-12(10-14)8-6-11/h5,10,12,15H,3-4,6-9H2,1-2H3InChIKey
ORMHZBNNECIKOH-UHFFFAOYSA-NSmiles
CC(C)Toxicity
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
rabbit | LD50 | skin | 11300uL/kg (11.3mL/kg) | BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) GASTROINTESTINAL: CHANGES IN STRUCTURE OR FUNCTION OF SALIVARY GLANDS | National Technical Information Service. Vol. OTS0535072, |
rat | LD50 | oral | 3250uL/kg (3.25mL/kg) | BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) SENSE ORGANS AND SPECIAL SENSES: LACRIMATION: EYE BEHAVIORAL: TREMOR | National Technical Information Service. Vol. OTS0535072, |