Butyl Citrate Structure

Butyl Citrate

Chemical Properties

Melting point ≥300 °C(lit.)
Boiling point 234 °C (17 mmHg)
Density  1.043 g/mL at 20 °C (lit.)
Pour Point  -62
refractive index  n20/D 1.445
Flash point 300 °C
storage temp.  Store below +30°C.
solubility  Miscible with acetone, ethanol, and vegetable oil; practically insoluble in water.
pka 11.30±0.29(Predicted)
form  Liquid
color  Clear
Odor odorless
Viscosity 32cp (25C)
Water Solubility  insoluble
Merck  14,1564
BRN  1806072
Cosmetics Ingredients Functions SOLVENT
PLASTICISER
FILM FORMING
InChI 1S/C18H32O7/c1-4-7-10-23-15(19)13-18(22,17(21)25-12-9-6-3)14-16(20)24-11-8-5-2/h22H,4-14H2,1-3H3
InChIKey ZFOZVQLOBQUTQQ-UHFFFAOYSA-N
SMILES CCCCOC(=O)CC(O)(CC(=O)OCCCC)C(=O)OCCCC
LogP 4.324 (est)
CAS DataBase Reference 77-94-1(CAS DataBase Reference)
Indirect Additives used in Food Contact Substances TRIBUTYL CITRATE
FDA 21 CFR 175.105
EWG's Food Scores 1
FDA UNII 827D5B1B6S
NIST Chemistry Reference Butyl citrate(77-94-1)
EPA Substance Registry System 1,2,3-Propanetricarboxylic acid, 2-hydroxy-, tributyl ester (77-94-1)
UNSPSC Code 41116107
NACRES NA.24
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Safety

Symbol(GHS) Corrosion (GHS05)
Signal wordDanger
Hazard statements H318
Precautionary statements P280-P305+P351+P338-P310
Hazard Codes  T
Risk Statements  25
Safety Statements  26-36/37/39-45-24/25
RIDADR  UN 2811 6.1/PG 2
WGK Germany  3
RTECS  TZ8608000
TSCA  TSCA listed
HS Code  29181500
Storage Class 10 - Combustible liquids
NFPA 704:
1
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