1,1-Dimethyl-5-methyleneheptyl isovalerate

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C15H28O2
Molecular Weight	240.3816
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1,1-Dimethyl-5-methyleneheptyl isovalerate

Structure Search

SMILES

CCC(=C)CCCC(C)(C)OC(=O)CC(C)C

InChI

InChIKey=YOUZPPOBZXKXHX-UHFFFAOYSA-N

InChI=1S/C15H28O2/c1-7-13(4)9-8-10-15(5,6)17-14(16)11-12(2)3/h12H,4,7-11H2,1-3,5-6H3

HIDE SMILES / InChI

Molecular Formula	C15H28O2
Molecular Weight	240.3816
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 `Tue Apr 01 19:11:49 GMT 2025` Edited by `admin` on `Tue Apr 01 19:11:49 GMT 2025`
Record UNII	D3UW58K89K
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1,1-Dimethyl-5-methyleneheptyl 3-methylbutanoate

Preferred Name

English

1,1-Dimethyl-5-methyleneheptyl isovalerate

Systematic Name

English

Butanoic acid, 3-methyl-, 1,1-dimethyl-5-methyleneheptyl ester

Systematic Name

English

Code System Code Type Description

PUBCHEM

16206165

Created by admin on Tue Apr 01 19:11:49 GMT 2025 , Edited by admin on Tue Apr 01 19:11:49 GMT 2025

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FDA UNII

D3UW58K89K

Created by admin on Tue Apr 01 19:11:49 GMT 2025 , Edited by admin on Tue Apr 01 19:11:49 GMT 2025

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ECHA (EC/EINECS)

306-312-6

Created by admin on Tue Apr 01 19:11:49 GMT 2025 , Edited by admin on Tue Apr 01 19:11:49 GMT 2025

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EPA CompTox

DTXSID10242590

Created by admin on Tue Apr 01 19:11:49 GMT 2025 , Edited by admin on Tue Apr 01 19:11:49 GMT 2025

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CAS

96846-76-3

Created by admin on Tue Apr 01 19:11:49 GMT 2025 , Edited by admin on Tue Apr 01 19:11:49 GMT 2025

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