AG00D95Q

53132-08-4 | 4-Ethoxyphenyl 4-propylbenzoate

AG00D95Q

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CAS Number	53132-08-4
Catalog Number	AG00D95Q(AGN-PC-02ZH1R)
Chemical Name	4-Ethoxyphenyl 4-propylbenzoate
IUPAC Name	(4-ethoxyphenyl) 4-propylbenzoate
InChI	InChI=1S/C18H20O3/c1-3-5-14-6-8-15(9-7-14)18(19)21-17-12-10-16(11-13-17)20-4-2/h6-13H,3-5H2,1-2H3
InChI Key	SVCUFJZAUTZZTN-UHFFFAOYSA-N
MDL Number	MFCD11053416
Molecular Formula	C18H20O3
Molecular Weight	284.3496
SMILES	CCCC1=CC=C(C=C1)C(=O)OC1=CC=C(OCC)C=C1
Synonyms	4-ETHOXYPHENYL 4-PROPYLBENZOATE, 53132-08-4, SCHEMBL10884021, CTK4J7115, DTXSID20607656, (4-ethoxyphenyl) 4-propylbenzoate, MFCD11053416, ZINC44137075, AKOS025402453, AC-9280, AN-7155, AK393979, DS-13317, 4-Propyl-benzoic acid 4-ethoxy-phenyl ester, FT-0752445,

Complexity	300
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	284.141g/mol
Formal Charge	0
Heavy Atom Count	21
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	284.355g/mol
Monoisotopic Mass	284.141g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	35.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	5

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

Lot Number