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Dibutyl adipate

Dibutyl adipate structure

CAS No:
105-99-7
Formula:
C14H26O4
Chemical Name:
Dibutyl adipate
Synonyms:
Hexanedioic acid,1,6-dibutyl ester;Adipic acid,dibutyl ester;Hexanedioic acid,dibutyl ester;3PS;Dibutyl adipate;Di-n-butyl adipate;Experimental Tick Repellent 3;Experimental Tick Repellent 3PS;Butyl adipate;Dibutyl hexanedioate;Adipic acid di-n-butyl ester;Polycizer W 260;Cetiol B;Monocizer W 260;NSC 8086;W 260;Adimoll DB;1,6-Dibutyl hexanedioate
Categories:
Cosmetic Ingredient > Film Forming

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Description

COLOURLESS LIQUID.

Liquid|COLOURLESS LIQUID.

Dibutyl adipate is a fatty acid ester.

Dibutyl adipate Basic Attributes

Molecular Weight：

258.35400

Exact Mass：

258.35

EC Number：

203-350-4

UNII：

F4K100DXP3

ICSC Number：

1705

NSC Number：

8086

UN Number：

3082

DSSTox ID：

DTXSID2021866

HScode：

2917120090

Characteristics

PSA：

52.60000

XLogP3：

3.23340

Appearance：

clear liquid

Density：

0.956 g/cm³ @ Temp: 20 °C

Melting Point：

-32.4 °C

Boiling Point：

145 °C @ Press: 4 Torr

Flash Point：

>110ºC

Refractive Index：

1.436

Water Solubility：

Solubility in water, g/100ml at 25°C: 0.0035 (very poor)

Vapor Pressure：

0.00109mmHg at 25°C

Vapor Density：

Relative vapour density (air = 1): 8.9

Safety Information

Hazard category：

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

R36/37/38

safety instructions：

S26; S36/37/39

RTECS Number：

AV0900000

Storage features：

Separated from strong oxidants and strong acids. Provision to contain effluent from fire extinguishing. Store in an area without drain or sewer access.

Precautionary statement(s)：

P201, P202, P273, P281, P308+P313, P391, P405, P501

Hazard Statements：

H361

Fire Hazards：

Combustible.

GHS Classification：

|H411 (95.45%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]|P273, P391, and P501|Aggregated GHS information provided by 175 companies from 5 notifications to the ECHA C&L Inventory.|Warning|H361: Suspected of damaging fertility or the unborn child [Warning Reproductive toxicity]|P201, P202, P281, P308+P313, P405, and P501

Fire Fighting：

Use water spray, dry powder.

Spillage Disposal：

Personal protection: protective gloves. Do NOT let this chemical enter the environment. Collect leaking liquid in sealable containers. Carefully collect remainder. Then store and dispose of according to local regulations.

Safe Storage：

Separated from strong oxidants and strong acids. Provision to contain effluent from fire extinguishing. Store in an area without drain or sewer access.

Inhalation Risk：

Evaporation at 20 °C is negligible; a nuisance-causing concentration of airborne particles can, however, be reached quickly on spraying.

Effects of Short Term Exposure：

The substance is mildly irritating to the skin.

Fire Prevention：

NO open flames.

Exposure Prevention：

PREVENT GENERATION OF MISTS!

Inhalation Prevention：

Use ventilation.

Skin Prevention：

Protective gloves.

Eye Prevention：

Wear safety spectacles.

Drug Information

First Aid：

Fresh air, rest.

Rinse skin with plenty of water or shower.

Rinse with plenty of water (remove contact lenses if easily possible).

MeSH Entry Terms：

dibutyl adipate

Symptoms：

Cough.

Redness.

Dibutyl adipate Use and Manufacturing

Uses

Used as an organic synthesis intermediate, generally used as a solvent. It can also be used as a plasticizer for vinyl and cellulose resins.

Ion exchange agents

Manufacturing Info：

Mining (except oil and gas) and support activities|Hexanedioic acid, 1,6-dibutyl ester: ACTIVE

Use Classification：

EPA Safer Chemical Functional Use Classes -> Solvents|Safer Chemical Classes -> Green circle - The chemical has been verified to be of low concern|Cosmetics -> Emollient; Film forming; Plasticiser

Computed Properties

Molecular Weight:258.35
XLogP3:3.1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:13
Exact Mass:258.18310931
Monoisotopic Mass:258.18310931
Topological Polar Surface Area:52.6
Heavy Atom Count:18
Complexity:202
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Material

Cyclohexanone

Cyclohexane

Adipic acid

Butyl acrylate

1-Butanol

Drug Function and Efficacy

Skin conditioning agent, improves texture and spreadability

This ingredient has been used in drugs with the following functions (note: it does not mean that the ingredient itself has the following health functions)

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Guide of Dibutyl adipate

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Use and Manufacturing
Computed Properties
Material
Drug Function and Efficacy
Related Drugs
Recommended Suppliers
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Dibutyl adipate

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