Nerolidol

CAS No.：40716-66-3

Important Notice

This product is a chemical product/pharmaceutical intermediate. It is not a drug, an active pharmaceutical ingredient (API), or a pharmaceutical-grade material. It has not been granted a drug approval number or a Chemical Drug Substance Approval Notice, has not passed drug-related review and approval, and is not manufactured, tested, or released in accordance with pharmaceutical GMP.
This product is intended solely for non-clinical research, process development, quality studies, further chemical processing, or chemical synthesis. It must not be used in drug-product manufacturing, clinical trials, clinical diagnosis, or administration to humans or animals, or be sold, used as an input, submitted for regulatory filing, or released as an API or pharmaceutical material.
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Nerolidol Basic information

Product Name:	Nerolidol
Synonyms:	Teprenone Impurity 19;trans-Nerolidal solution;(6E)-3,7,11-Trimethyl-1,6,10-dodecatrien-3-ol;1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, (E)-;Trans-(E)-Nerolidol;3-Hydroxy-3,7,11-trimethyl-1,6,10-dodecatriene;Nerolidol;(E)-3,7,11-trimethyldodeca-1,6,10-trien-3-ol
CAS:	40716-66-3
MF:	C15H26O
MW:	222.37
EINECS:	255-053-4
Product Categories:
Mol File:	40716-66-3.mol

Nerolidol Chemical Properties

Boiling point	145-146 °C12 mm Hg(lit.)
density	0.876 g/mL at 25 °C(lit.)
refractive index	n20/D 1.479(lit.)
Fp	230 °F
storage temp.	-20°C
form	neat
pka	14.40±0.29(Predicted)
JECFA Number	1646
Merck	13,6501
BRN	5731231
NIST Chemistry Reference	1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, (e)-(40716-66-3)

Safety Information

Hazard Codes	Xi
Risk Statements	36/37/38
Safety Statements	26-36
RIDADR	UN1230 - class 3 - PG 2 - Methanol, solution
WGK Germany	1
F	10-23
toxicity	Both the acute oral LD₅₀ in rats and the acute dermal LD₅₀ in rabbits exceeded 5 g/kg (Russell. 1973).

MSDS Information

Nerolidol Usage And Synthesis

Description	trans-Nerolidol is a sesquiterpene that has been found in various plants, including C. sativa, and has diverse biological activities, including antimicrobial, antioxidant, anticancer, and insecticidal properties. In a disc assay, trans-nerolidol inhibits the growth of S. aureus, B. subtilis, E. coli, and S. cerevisiae with zones of inhibition measuring 10, 9, 10, and 4 mm, respectively. It reduces viability of CaCo-2 adenocarcinoma cells with an IC₅₀ value of 28.7 mg/L and reduces production of reactive oxygen species (ROS). trans-Nerolidol is insecticidal against A. aegypti larvae with a 24-hour LC₅₀ value of 9 mg/L.
Occurrence	Reported to be found in cabreuva oil, oil of neroli, balsam Peru, ylang ylang and many others (Gildemeister & Hoffman, 1959).
Preparation	By isolation from a suitable essential oil or by chemical synthesis.

Nerolidol Preparation Products And Raw materials

Raw materials	5-Hepten-1-yne, 6-methyl--->Diphosphoric acid, mono[(2Z,6E)-3,7,11-trimethyl-2,6,10-dodecatrien-1-yl] ester-->CIS-TRANS-FARNESOL-->GERANYL BROMIDE-->Geranylacetone
Preparation Products	Teprenone Impurity 20-->(E)-BETA-FARNESENE-->(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienal

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