77-90-7

Name Acetyl tributyl citrate
CAS 77-90-7
EINECS(EC#) 201-067-0
Molecular Formula C20H34O8
MDL Number MFCD00043554
Molecular Weight 402.48
MOL File 77-90-7.mol

Chemical Properties

Definition Aqueous-based pharmaceutical coat- ings.
Appearance clear colorless liquid
Melting point  -59 °C
Boiling point  327 °C
density  1.05 g/mL at 25 °C(lit.)
Pour Point  -43
vapor pressure  0.26 psi ( 20 °C)
FEMA  3080
refractive index  n20/D 1.443(lit.)
Fp  >230 °F
storage temp.  Store below +30°C.
solubility  Not miscible with water, miscible with ethanol (96 per cent) and with methylene chloride.
form  neat
color  Clear Colourless
Odor at 100.00 %. very faint herbal wine sweet
biological source synthetic
Odor Type herbal
Water Solubility  <0.1 g/100 mL
FreezingPoint  -80℃
JECFA Number 630
BRN  2303316
Henry's Law Constant 2.6×104 mol/(m3Pa) at 25℃, HSDB (2015)
Cosmetics Ingredients Functions FRAGRANCE
PERFUMING
PLASTICISER
Cosmetic Ingredient Review (CIR) Acetyl tributyl citrate (77-90-7)
InChI 1S/C20H34O8/c1-5-8-11-25-17(22)14-20(28-16(4)21,19(24)27-13-10-7-3)15-18(23)26-12-9-6-2/h5-15H2,1-4H3
InChIKey QZCLKYGREBVARF-UHFFFAOYSA-N
SMILES CCCCOC(=O)CC(CC(=O)OCCCC)(OC(C)=O)C(=O)OCCCC
LogP 5.227 (est)
CAS DataBase Reference 77-90-7(CAS DataBase Reference)
NIST Chemistry Reference 1,2,3-Propanetricarboxylic acid, 2-(acetyloxy)-, tributyl ester(77-90-7)
EPA Substance Registry System 77-90-7(EPA Substance)

Safety Data

Symbol(GHS) 
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Safety Statements 
S24/25:Avoid contact with skin and eyes .
WGK Germany  3
RTECS  TZ8330000
TSCA  TSCA listed
REACH Registrations Active
HS Code  29181500
Storage Class 10 - Combustible liquids
Safety Profile
When heated to decomposition it emits acrid smoke and irritating fumes. ADD750
Hazardous Substances Data 77-90-7(Hazardous Substances Data)

Raw materials And Preparation Products

Hazard Information

Material Safety Data Sheet(MSDS)

Well-known Reagent Company Product Information

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