Methyl 3-(o-(hexadecyloxy)phenyl)-3-oxopropionate

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C26H42O4
Molecular Weight	418.6093
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Methyl 3-(o-(hexadecyloxy)phenyl)-3-oxopropionate

Structure Search

SMILES

CCCCCCCCCCCCCCCCOC1=C(C=CC=C1)C(=O)CC(=O)OC

InChI

InChIKey=IPJRKWPQYPZWAJ-UHFFFAOYSA-N

InChI=1S/C26H42O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-21-30-25-20-17-16-19-23(25)24(27)22-26(28)29-2/h16-17,19-20H,3-15,18,21-22H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C26H42O4
Molecular Weight	418.6093
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 20:07:07 GMT 2023` Edited by `admin` on `Sat Dec 16 20:07:07 GMT 2023`
Record UNII	XMF68KW675
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Methyl 3-(o-(hexadecyloxy)phenyl)-3-oxopropionate

Common Name

English

Methyl 2-(hexadecyloxy)-β-oxobenzenepropanoate

Systematic Name

English

Benzenepropanoic acid, 2-(hexadecyloxy)-β-oxo-, methyl ester

Systematic Name

English

Code System Code Type Description

PUBCHEM

108656

Created by admin on Sat Dec 16 20:07:07 GMT 2023 , Edited by admin on Sat Dec 16 20:07:07 GMT 2023

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FDA UNII

XMF68KW675

Created by admin on Sat Dec 16 20:07:07 GMT 2023 , Edited by admin on Sat Dec 16 20:07:07 GMT 2023

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EPA CompTox

DTXSID20203556

Created by admin on Sat Dec 16 20:07:07 GMT 2023 , Edited by admin on Sat Dec 16 20:07:07 GMT 2023

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CAS

55017-92-0

Created by admin on Sat Dec 16 20:07:07 GMT 2023 , Edited by admin on Sat Dec 16 20:07:07 GMT 2023

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ECHA (EC/EINECS)

259-434-6

Created by admin on Sat Dec 16 20:07:07 GMT 2023 , Edited by admin on Sat Dec 16 20:07:07 GMT 2023

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