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Substance Name: Nerol
RN: 106-25-2
UNII: 38G5P53250
InChIKey: GLZPCOQZEFWAFX-YFHOEESVSA-N
Note
- Nerol is cis isomer of geraniol; used in perfumery.
Classification Codes
- Natural Product
- Skin / Eye Irritant
Molecular Formula
- C10-H18-O
Molecular Weight
- 154.2512
- All
- Links to Resources
- Names & Synonyms
- Registry Numbers
- Structure Descriptors
- Toxicity
- Physical Properties
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Names and Synonyms
Name of Substance
- Nerol
Synonyms
- (Z)-Geraniol
- 2,6-Octadien-1-ol, 3,7-dimethyl-, (Z)-
- 2-cis-3,7-Dimethyl-2,6-octadien-1-ol
- 3,7-Dimethyl-2,6-octadien-1-ol, (Z)-
- 3,7-Dimethyl-2,6-octadien-1-ol, cis-
- AI3-28202
- cis-Geraniol
- EC 203-378-7
- EINECS 203-378-7
- FEMA No. 2770
- HSDB 8262
- Nerol
- Nerol (natural)
- Nerol 900
- Neryl alcohol
- NSC-46105
- UNII-38G5P53250
Systematic Names
- 2,6-Octadien-1-ol, 3,7-dimethyl-, (2Z)-
- 2,6-Octadien-1-ol, 3,7-dimethyl-, (Z)-
- Nerol
Superlist Names
- 2,6-Octadien-1-ol, 3,7-dimethyl-, (Z)-
- Nerol
Registry Numbers
CAS Registry Number
- 106-25-2
FDA UNII
- 38G5P53250
System Generated Number
- 0000106252
Structure Descriptors
InChI
InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,7,11H,4,6,8H2,1-3H3/b10-7-InChIKey
GLZPCOQZEFWAFX-YFHOEESVSA-NSmiles
CC(=CCC\C(=C/CO)Toxicity
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intramuscular | 3gm/kg (3000mg/kg) | Journal of Scientific and Industrial Research, Section C: Biological Sciences. Vol. 21, Pg. 342, 1962. | |
rabbit | LD50 | skin | > 5gm/kg (5000mg/kg) | Food and Cosmetics Toxicology. Vol. 14, Pg. 623, 1976. | |
rat | LD50 | oral | 4500mg/kg (4500mg/kg) | Food and Cosmetics Toxicology. Vol. 14, Pg. 623, 1976. |
Physical Properties
Physical Property | Value | Units | Temp (deg C) | Source |
---|---|---|---|---|
Melting Point | -1.50E+01 | deg C | EXP | |
Boiling Point | 225 | deg C | EXP | |
log P (octanol-water) | 3.47 | (none) | EXP | |
Henry's Law Constant | 1.15E-05 | atm-m3/mole | 25 | EST |
Atmospheric OH Rate Constant | 1.80E-10 | cm3/molecule-sec | 25 | EST |
Physical property data is provided to ChemIDplus by SRC, Inc.