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cis-Nerolidol

cis-Nerolidol structure

CAS No:
3790-78-1
Formula:
C15H26O
Chemical Name:
cis-Nerolidol
Synonyms:
1,6,10-Dodecatrien-3-ol,3,7,11-trimethyl-,(6Z)-;1,6,10-Dodecatrien-3-ol,3,7,11-trimethyl-,(Z)-;(6Z)-3,7,11-Trimethyl-1,6,10-dodecatrien-3-ol;cis-Nerolidol;(Z)-Nerolidol;(±)-cis-Nerolidol;(6Z)-3,7,11-Trimethyl-1,6,10-dodecatrien-3-ol;24163-92-6;53991-23-4
Categories:
Biochemical Engineering > Plant Extracts

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Description

Colourless or very pale straw-coloured oily liquid; Faint woody-floral, slightly rose apple aroma

(6Z)-nerolidol is a nerolidol in which the double bond at position 6 adopts a cis-configuration.

cis-Nerolidol Basic Attributes

Molecular Weight：

222.37

Exact Mass：

222.37

EC Number：

205-540-2

DSSTox ID：

DTXSID1047239

HScode：

2905290000

Characteristics

PSA：

20.2

XLogP3：

4.39630

Appearance：

Colourless or very pale straw-coloured oily liquid; Faint woody-floral, slightly rose apple aroma

Density：

0.8785 g/cm³ @ Temp: 20 °C

Boiling Point：

123-125 °C @ Press: 4 Torr

Flash Point：

96℃

Refractive Index：

n20/D 1.478(lit.)

Water Solubility：

Soluble in most fixed oils and propylene glycol; slightly soluble in water; insoluble in glycerol

Storage Conditions：

2-8°C

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

36/37/38

safety instructions：

26-36

Marks：

Precautionary statement(s)：

P261, P264, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P391, P403+P233, P405, P501

Hazard Statements：

H315

GHS Classification：

|Warning|H315 (13.97%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P391, P403+P233, P405, and P501|Aggregated GHS information provided by 272 companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

3,7,11-trimethyl-1,6,10-dodecatrien-3-ol

cis-Nerolidol Use and Manufacturing

Manufacturing Info：

1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, (3S,6Z)-: ACTIVE

Use Classification：

Food additives -> Flavoring Agents|Flavoring Agents -> JECFA Flavorings Index

Food Additive Classes：

Flavoring Agents

Computed Properties

Molecular Weight:222.37
XLogP3:4.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:7
Exact Mass:222.198365449
Monoisotopic Mass:222.198365449
Topological Polar Surface Area:20.2
Heavy Atom Count:16
Complexity:269
Undefined Atom Stereocenter Count:1
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of cis-Nerolidol

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Use and Manufacturing
Computed Properties
Learn More Other Chemicals

cis-Nerolidol

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