AG002T14

26399-02-0 | 9-Octadecenoic acid (9Z)-, 2-ethylhexyl ester

AG002T14

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CAS Number	26399-02-0
Catalog Number	AG002T14(AGN-PC-0R2DQF)
Chemical Name	9-Octadecenoic acid (9Z)-, 2-ethylhexyl ester
EC Number	247-655-0
IUPAC Name	2-ethylhexyl (Z)-octadec-9-enoate
InChI	InChI=1S/C26H50O2/c1-4-7-9-10-11-12-13-14-15-16-17-18-19-20-21-23-26(27)28-24-25(6-3)22-8-5-2/h14-15,25H,4-13,16-24H2,1-3H3/b15-14-
InChI Key	FOKDITTZHHDEHD-PFONDFGASA-N
MDL Number	MFCD00072286
Molecular Formula	C26H50O2
Molecular Weight	394.6740
SMILES	C(CCCCCCCC=C/CCCCCCCC)(=O)OCC(CCCC)CC
Synonyms	2-Ethylhexyl oleate, 26399-02-0, EINECS 247-655-0, 9-Octadecenoic acid (Z)-, 2-ethylhexyl ester, EC 247-655-0, AC1O5OW6, Oleic acid 2-ethylhexyl ester, SCHEMBL333602, 2-ethylhexyl (Z)-octadec-9-enoate, ethylhexyl oleate, 9-octadecenoic acid, 2- ethylhexyl oleate, 2-Ethylhexyl 9-octadecenoate, UNII-R34927QY59, C26-H50-O2, CID6438028, R34927QY59, 9-Octadecenoic acid (9Z)-, 2-ethylhexyl ester, 9-Octadecenoic acid, 2-ethylhexyl ester, (Z)-,

Complexity	348
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Exact Mass	394.381g/mol
Formal Charge	0
Heavy Atom Count	28
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	394.684g/mol
Monoisotopic Mass	394.381g/mol
Rotatable Bond Count	22
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	10.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number