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Substance Name: Linalool
RN: 78-70-6
UNII: D81QY6I88E
InChIKey: CDOSHBSSFJOMGT-UHFFFAOYSA-N
Classification Codes
- Insecticide
- Insecticides
- Mutation Data
- Pesticides
- Skin / Eye Irritant
Molecular Formula
- C10-H18-O
Molecular Weight
- 154.251
- All
- Links to Resources
- Names & Synonyms
- Registry Numbers
- Structure Descriptors
- Toxicity
- Physical Properties
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Names and Synonyms
Name of Substance
- 1,6-Octadien-3-ol, 3,7-dimethyl-
- 2,6-Dimethyl-2,7-octadien-6-ol
- 2,7-Octadien-6-ol, 2,6-dimethyl-
- 3,7-Dimethyl-1,6-octadien-3-ol
- Linalool
Synonyms
- (+-)-Linalool
- 0-01-00-00462 (Beilstein Handbook Reference)
- 1,6-Octadien-3-ol, 3,7-dimethyl-
- 2,6-Dimethyl-2,7-octadiene-6-ol
- 2,6-Dimethylocta-2,7-dien-6-ol
- 3,7-Dimethyl-1,6-octadien-3-ol
- 3,7-Dimethylocta-1,6-dien-3-ol
- AI3-00942
- Allo-ocimenol
- beta-Linalool
- BRN 1721488
- Caswell No. 526A
- CCRIS 6557
- EC 201-134-4
- EINECS 201-134-4
- EINECS 245-083-6
- EPA Pesticide Chemical Code 128838
- FEMA No. 2635
- FEMA Number 2635
- HSDB 645
- Linalool
- Linalool (natural)
- Linalyl alcohol
- NSC 3789
- p-Linalool
- UNII-D81QY6I88E
Systematic Names
- (1)-3,7-Dimethyl-1,6-octadien-3-ol
- 1,6-Octadien-3-ol, 3,7-dimethyl-
- 3,7-Dimethyl-1,6-octadien-3-ol
- Linalool
Superlist Names
- 1,6-Octadien-3-ol, 3,7-dimethyl-
- Linalool
- Linalyl alcohol
Registry Numbers
CAS Registry Number
- 78-70-6
FDA UNII
- D81QY6I88E
Other Registry Numbers
- 11024-20-7
- 22564-99-4
System Generated Number
- 0000078706
Structure Descriptors
InChI
InChI=1S/C10H18O/c1-5-10(4,11)8-6-7-9(2)3/h5,7,11H,1,6,8H2,2-4H3InChIKey
CDOSHBSSFJOMGT-UHFFFAOYSA-NSmiles
CC(=CCCC(C)Toxicity
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intramuscular | 8gm/kg (8000mg/kg) | Journal of Scientific and Industrial Research, Section C: Biological Sciences. Vol. 21, Pg. 342, 1962. | |
mouse | LD50 | intraperitoneal | 340mg/kg (340mg/kg) | BEHAVIORAL: ATAXIA BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) | Izvestiya na Instituta po Fiziologiya, Bulgarska Akademiya na Naukite. Vol. 15, Pg. 149, 1973. |
mouse | LD50 | oral | 3gm/kg (3000mg/kg) | BEHAVIORAL: ATAXIA LUNGS, THORAX, OR RESPIRATION: DYSPNEA BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) | National Technical Information Service. Vol. OTS0543729, |
mouse | LD50 | subcutaneous | 1470mg/kg (1470mg/kg) | PERIPHERAL NERVE AND SENSATION: SPASTIC PARALYSIS WITH OR WITHOUT SENSORY CHANGE | Sapporo Igaku Zasshi. Sapporo Medical Journal. Vol. 3, Pg. 73, 1952. |
rabbit | LD50 | skin | 5610mg/kg (5610mg/kg) | Food and Cosmetics Toxicology. Vol. 13, Pg. 827, 1975. | |
rat | LD50 | intraperitoneal | 307mg/kg (307mg/kg) | BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) BEHAVIORAL: ATAXIA | Izvestiya na Instituta po Fiziologiya, Bulgarska Akademiya na Naukite. Vol. 15, Pg. 149, 1973. |
rat | LD50 | oral | 2790mg/kg (2790mg/kg) | BEHAVIORAL: ATAXIA | Food and Cosmetics Toxicology. Vol. 2, Pg. 327, 1964. |
rat | LD50 | skin | 5610mg/kg (5610mg/kg) | "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986Vol. -, Pg. 202, 1986. |
Physical Properties
Physical Property | Value | Units | Temp (deg C) | Source |
---|---|---|---|---|
Melting Point | < 25 | deg C | EXP | |
Boiling Point | 197 | deg C | EXP | |
log P (octanol-water) | 2.97 | (none) | EXP | |
Water Solubility | 1590 | mg/L | 25 | EXP |
Vapor Pressure | 0.16 | mm Hg | 25 | EXP |
Henry's Law Constant | 2.15E-05 | atm-m3/mole | 25 | EXP |
Atmospheric OH Rate Constant | 1.60E-10 | cm3/molecule-sec | 23 | EXP |
Physical property data is provided to ChemIDplus by SRC, Inc.