AG003DPJ

17088-28-7 | 1,4-Phenylenediacrylic acid diethyl ester

AG003DPJ

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CAS Number	17088-28-7
Catalog Number	AG003DPJ(AGN-PC-0JLW9U)
Chemical Name	1,4-Phenylenediacrylic acid diethyl ester
EC Number	241-150-9
IUPAC Name	ethyl 3-[4-(3-ethoxy-3-oxoprop-1-enyl)phenyl]prop-2-enoate
InChI	InChI=1S/C16H18O4/c1-3-19-15(17)11-9-13-5-7-14(8-6-13)10-12-16(18)20-4-2/h5-12H,3-4H2,1-2H3
InChI Key	QYGWZBFQWUBYAT-UHFFFAOYSA-N
MDL Number	MFCD00017521
Molecular Formula	C16H18O4
Molecular Weight	274.3117
SMILES	CCOC(=O)C=Cc1ccc(C=CC(=O)OCC)cc1
Synonyms	Diethyl p-benzenediacrylate, 17088-28-7, 2-Propenoic acid, 3,3'-(1,4-phenylene)bis-, 1,1'-diethyl ester, Diethyl 3,3'-(1,4-phenylene)bisacrylate, Diethyl 1,4-Phenylenediacrylate, EINECS 241-150-9, ACMC-209e1t, AC1L3BP2, diethyl-p-phenylenediacrylate, SCHEMBL5059085, CTK4D3737, ANW-22479, DB-043842, FT-0606927, ethyl 3-[4-(3-ethoxy-3-oxoprop-1-enyl)phenyl]prop-2-enoate, 2-Propenoic acid,3,3'-(1,4-phenylene)bis-, 1,1'-diethyl ester, 1,4-Phenylenediacrylic Acid Diethyl Ester, UNII-07BT5G3526, C16H18O4, CID86506, C16-H18-O4, 2-Propenoic acid, 3,3'-(1,4-phenylene)bis-, diethyl ester,

Complexity	327
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	274.121g/mol
Formal Charge	0
Heavy Atom Count	20
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	274.316g/mol
Monoisotopic Mass	274.121g/mol
Rotatable Bond Count	8
Topological Polar Surface Area	52.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	2
XLogP3	3.2

GHS Hazard and Precautionary Statements

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

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