AG007MJ5

26855-43-6 | Triglycerol monostearate

AG007MJ5

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CAS Number	26855-43-6
Catalog Number	AG007MJ5(AGN-PC-0R2RVM)
Chemical Name	Triglycerol monostearate
IUPAC Name	[3-[3-(2,3-dihydroxypropoxy)-2-hydroxypropoxy]-2-hydroxypropyl] octadecanoate
InChI	InChI=1S/C27H54O8/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-27(32)35-23-26(31)22-34-21-25(30)20-33-19-24(29)18-28/h24-26,28-31H,2-23H2,1H3
InChI Key	JHSNLCCMZMGXLK-UHFFFAOYSA-N
MDL Number	MFCD00152930
Molecular Formula	C27H60O11
Molecular Weight	560.7587
SMILES	OCC(CO)O.OCC(CO)O.OCC(CO)O.CCCCCCCCCCCCCCCCCC(=O)O
Synonyms	26855-43-6, 150616-94-7, C27H54O8, Triglycerol stearate, Triglycerol monostearate, tech., Triglycerol monostearate, AldrichCPR, MFCD00152930, AKOS025311013, octadecanoic acid,propane-1,2,3-triol, ACM26855436, O570, Octadecanoic acid monoester with triglycerol, K-6888, TRIGLYCEROL MONOSTEARATE, Triglycerolmonostearate, Polyglyceryl-3 stearate, EINECS 248-403-2, Stearic acid, monoester with triglycerol, C27-H54-O8, CID9957863, [3-[3-(2,3-dihydroxypropoxy)-2-hydroxy-propoxy]-2-hydroxy-propyl] Octadecanoate, 27321-72-8,

Complexity	449
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	506.382g/mol
Formal Charge	0
Heavy Atom Count	35
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	4
Isotope Atom Count	0
Molecular Weight	506.721g/mol
Monoisotopic Mass	506.382g/mol
Rotatable Bond Count	28
Topological Polar Surface Area	126A^2
Undefined Atom Stereocenter Count	3
Undefined Bond Stereocenter Count	0
XLogP3	5.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H302-H315-H319-H335
Packing Group	\N
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code	\N

Certificate of Analysis

Lot Number