2-Butenoic acid, 3-methyl-, 3-methyl-3-butenyl ester

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H16O2
Molecular Weight	168.2328
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-Butenoic acid, 3-methyl-, 3-methyl-3-butenyl ester

Structure Search

SMILES

CC(=C)CCOC(=O)C=C(C)C

InChI

InChIKey=GRTNNHGFEQUXEO-UHFFFAOYSA-N

InChI=1S/C10H16O2/c1-8(2)5-6-12-10(11)7-9(3)4/h7H,1,5-6H2,2-4H3

HIDE SMILES / InChI

Molecular Formula	C10H16O2
Molecular Weight	168.2328
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 `Mon Mar 31 22:06:30 GMT 2025` Edited by `admin` on `Mon Mar 31 22:06:30 GMT 2025`
Record UNII	PUA7GWY6FV
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-Butenoic acid, 3-methyl-, 3-methyl-3-buten-1-yl ester

Preferred Name

English

2-Butenoic acid, 3-methyl-, 3-methyl-3-butenyl ester

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID3072666

Created by admin on Mon Mar 31 22:06:30 GMT 2025 , Edited by admin on Mon Mar 31 22:06:30 GMT 2025

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ECHA (EC/EINECS)

277-069-0

Created by admin on Mon Mar 31 22:06:30 GMT 2025 , Edited by admin on Mon Mar 31 22:06:30 GMT 2025

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FDA UNII

PUA7GWY6FV

Created by admin on Mon Mar 31 22:06:30 GMT 2025 , Edited by admin on Mon Mar 31 22:06:30 GMT 2025

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CAS

72928-35-9

Created by admin on Mon Mar 31 22:06:30 GMT 2025 , Edited by admin on Mon Mar 31 22:06:30 GMT 2025

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PUBCHEM

166366

Created by admin on Mon Mar 31 22:06:30 GMT 2025 , Edited by admin on Mon Mar 31 22:06:30 GMT 2025

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