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Hexadecanolide

Hexadecanolide structure

CAS No:
109-29-5
Formula:
C16H30O2
Chemical Name:
Hexadecanolide
Synonyms:
Oxacycloheptadecan-2-one;Hexadecanoic acid,16-hydroxy-,o-lactone;Hexadecanoic acid,16-hydroxy-,ο-lactone;Hexadecanolide;Dihydroambrettolide;1,16-Hexadecanolide;16-Hexadecanolactone;Juniperic acid lactone;Cyclohexadecanolide;Hexadecanolactone;NSC 33546;1-Oxacycloheptadecan-2-one;ω-Hexadecalactone
Categories:
Cosmetic Ingredient > Perfuming

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Description

colourless to light yellow solid

16-Hexadecanolide is a macrolide.

Hexadecanolide Basic Attributes

Molecular Weight：

254.41

Exact Mass：

254.41

EC Number：

203-662-0

UNII：

64E2HO00C7

NSC Number：

33546

DSSTox ID：

DTXSID4047622

HScode：

2932209090

Characteristics

PSA：

26.30000

XLogP3：

5.00460

Appearance：

colourless to light yellow solid

Density：

0.9324 g/cm³

Melting Point：

33.5-33.8 °C @ Solvent: Ethanol, 80%

Boiling Point：

127-129 °C @ Press: 2.5 Torr

Flash Point：

>100°C

Refractive Index：

n20/D1.4680-1.4730

Water Solubility：

Insoluble in water.

Storage Conditions：

-20ºC

Vapor Pressure：

2.6E-05mmHg at 25°C

Toxicity：

CYCLOHEXADECANOLIDE DIHYDROAMBRETTOLIDE 1,16-HEXADECANOLACTONE HEXADECANOLIDE 16-HYDROXYHEXADECANOIC ACID LACTONE JUNIPERIC ACID LACTONE

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

R36/38

safety instructions：

RTECS Number：

RN9730000

Marks：

Stability/Shelf Life：

Stable. Combustible. Incompatible with strong oxidizing agents.

Precautionary statement(s)：

P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, P362

Hazard Statements：

H315

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362|Aggregated GHS information provided by 313 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

hexadecanolide

Hexadecanolide Use and Manufacturing

Manufacturing Info：

Oxacycloheptadecan-2-one: ACTIVE

Use Classification：

EPA Safer Chemical Functional Use Classes -> Fragrances|Safer Chemical Classes -> Green half-circle - The chemical is expected to be of low concern|Food additives -> Flavoring Agents|Fatty Acyls [FA] -> Fatty esters [FA07] -> Lactones [FA0704]

Food Additive Classes：

Flavoring Agents

Computed Properties

Molecular Weight:254.41
XLogP3:6.3
Hydrogen Bond Acceptor Count:2
Exact Mass:254.224580195
Monoisotopic Mass:254.224580195
Topological Polar Surface Area:26.3
Heavy Atom Count:18
Complexity:201
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Hexadecanolide

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

Hexadecanolide

SDS

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