AG003QGX

111-61-5 | Stearic Acid ethyl ester

AG003QGX

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CAS Number	111-61-5
Catalog Number	AG003QGX(AGN-PC-0JK8E0)
Chemical Name	Stearic Acid ethyl ester
EC Number	203-887-4
FEMA Number	3490
IUPAC Name	ethyl octadecanoate
InChI	InChI=1S/C20H40O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22-4-2/h3-19H2,1-2H3
InChI Key	MVLVMROFTAUDAG-UHFFFAOYSA-N
MDL Number	MFCD00009006
Molecular Formula	C20H40O2
Molecular Weight	312.5304
NSC Number	8919
SMILES	CCCCCCCCCCCCCCCCCC(OCC)=O
UNII	C64RTC734W
Synonyms	ethyl octadecanoate, ethyl stearate, octadecanoic acid ethyl ester, ETHYL STEARATE, Ethyl octadecanoate, 111-61-5, Stearic acid ethyl ester, Octadecanoic acid, ethyl ester, Ethyl n-octadecanoate, Stearic acid, ethyl ester, Dicyclohexylammonium sulfate, UNII-C64RTC734W, FEMA No. 3490, NSC 8919, EINECS 203-887-4, MFCD00009006, BRN 1788183, octadecanoic acid ethyl ester, AI3-01781, C64RTC734W, MVLVMROFTAUDAG-UHFFFAOYSA-N, C20H40O2, Ethyl stearate, 97%, AK114522, ethyl-stearate, Ethyloctadecanoate, Stearic acid ethyl, Ethyl ocatadecanoate, Radia 7185, AC1L1QBB, ACMC-1C2UL, E(R) degrees EEaOOo yen, Ethyl stearate, >=97%, Dicyclohexylammonium sulphate, SCHEMBL24287, Octadecanoic acid-ethyl ester, 4-02-00-01218 (Beilstein Handbook Reference), KSC494G4H, Octacecanoic acid, ethy ester, QSPL 077, QSPL 080, QSPL 085, QSPL 088, QSPL 132, DTXSID5059406, CHEBI:84936, CTK3J4343, FEMA 3490, NSC8919, HMS3650O05, Ethyl stearate, analytical standard, NSC-8919, Ethyl octadecanoate (ethyl stearate), ANW-16299, LMFA07010883, SBB061283, ZINC64858945, AKOS004910332, LS-2743, MCULE-3414589628, RTR-002287, TRA0073166, Ethyl stearate, >=99% (capillary GC), AN-22670, CC-28226, U168, AX8129516, TR-002287, FT-0668391, S0079, S0365, ST24030696, ST51047314, Ethyl stearate, Vetec(TM) reagent grade, 97%, C-19333, SR-01000946815, J-002604, SR-01000946815-1, I14-13854, UNII-89IR26S11S component MVLVMROFTAUDAG-UHFFFAOYSA-N, UNII-ANA2NCS6V1 component MVLVMROFTAUDAG-UHFFFAOYSA-N, UNII-PY7890FR5M component MVLVMROFTAUDAG-UHFFFAOYSA-N, Ethyl stearate, United States Pharmacopeia (USP) Reference Standard, octadecansaureethylester, Oktadecansaureethylester, STEARATE, ETHYL, CID8122, C20-H40-O2, WE(20:0),

Complexity	226
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	312.303g/mol
Formal Charge	0
Heavy Atom Count	22
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	312.538g/mol
Monoisotopic Mass	312.303g/mol
Rotatable Bond Count	18
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	8.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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