AG003PAW

20306-22-3 | Diallyl 1,4-Cyclohexanedicarboxylate

AG003PAW

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CAS Number	20306-22-3
Catalog Number	AG003PAW(AGN-PC-005L2P)
Chemical Name	Diallyl 1,4-Cyclohexanedicarboxylate
IUPAC Name	bis(prop-2-enyl) cyclohexane-1,4-dicarboxylate
InChI	InChI=1S/C14H20O4/c1-3-9-17-13(15)11-5-7-12(8-6-11)14(16)18-10-4-2/h3-4,11-12H,1-2,5-10H2
InChI Key	ZXTPJLLIHIDBKQ-UHFFFAOYSA-N
MDL Number	MFCD00050452
Molecular Formula	C14H20O4
Molecular Weight	252.3062
SMILES	C=CCOC(=O)C1CCC(CC1)C(=O)OCC=C
Synonyms	Diallyl 1,4-Cyclohexanedicarboxylate, 20306-22-3, Diallyl 1,4-cyclohexanedicarboxylate (cis- and trans- mixture), 1,4-Cyclohexanedicarboxylic Acid Diallyl Ester, SCHEMBL423892, CTK0J0598, DTXSID10460575, ZINC2510031, MFCD00050452, AKOS025294850, TR-036102, D3768, DIALLYL-1,4-CYCLOHEXANE-DICARBOXYLATE, 1,4-Cyclohexanedicarboxylic acid, di-2-propenyl ester, diallyl 1,4-Cyclohexanedicarboxylate(cis-and trans-mixture), CID11265237, Diprop-2-enyl Cyclohexane-1,4-dicarboxylate, bis(prop-2-enyl) cyclohexane-1,4-dicarboxylate,

Complexity	282
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	252.136g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	252.31g/mol
Monoisotopic Mass	252.136g/mol
Rotatable Bond Count	8
Topological Polar Surface Area	52.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number