9-Octadecenoic acid (9Z)-, 1,2,3-propanetriyl ester


Chemical Name: 9-Octadecenoic acid (9Z)-, 1,2,3-propanetriyl ester
CAS Number: 122-32-7
Product Number: AG003V57(AGN-PC-0PG2AQ)
Synonyms:
MDL No:
Molecular Formula: C57H104O6
Molecular Weight: 885.4321

Identification/Properties


Properties
MP:
-5,5°C
BP:
818.7°C at 760 mmHg
Storage:
Keep in dry area;-10 ℃;
Form:
Liquid
Refractive Index:
n20/D 1.470
Solubility:
chloroform: 0.1 g/mL, clear, colorless
Computed Properties
Molecular Weight:
885.453g/mol
XLogP3:
22.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
53
Exact Mass:
884.783g/mol
Monoisotopic Mass:
884.783g/mol
Topological Polar Surface Area:
78.9A^2
Heavy Atom Count:
63
Formal Charge:
0
Complexity:
1010
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302
Precautionary Statements:
P264-P270-P301+P312-P330
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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