2,2,4-Trimethyl-3-pentenal

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H14O
Molecular Weight	126.1962
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2,2,4-Trimethyl-3-pentenal

Structure Search

SMILES

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

InChI

InChIKey=QJJLGDXUAXOUBP-UHFFFAOYSA-N

InChI=1S/C8H14O/c1-7(2)5-8(3,4)6-9/h5-6H,1-4H3

HIDE SMILES / InChI

Molecular Formula	C8H14O
Molecular Weight	126.1962
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 13:16:02 GMT 2023` Edited by `admin` on `Sat Dec 16 13:16:02 GMT 2023`
Record UNII	92R9KNS8K2
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2,2,4-Trimethyl-3-pentenal

Systematic Name

English

NSC-92370

Code

English

3-Pentenal, 2,2,4-trimethyl-

Systematic Name

English

Code System Code Type Description

PUBCHEM

260717

Created by admin on Sat Dec 16 13:16:02 GMT 2023 , Edited by admin on Sat Dec 16 13:16:02 GMT 2023

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CAS

5842-49-9

Created by admin on Sat Dec 16 13:16:02 GMT 2023 , Edited by admin on Sat Dec 16 13:16:02 GMT 2023

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EPA CompTox

DTXSID70293801

Created by admin on Sat Dec 16 13:16:02 GMT 2023 , Edited by admin on Sat Dec 16 13:16:02 GMT 2023

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FDA UNII

92R9KNS8K2

Created by admin on Sat Dec 16 13:16:02 GMT 2023 , Edited by admin on Sat Dec 16 13:16:02 GMT 2023

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NSC

92370

Created by admin on Sat Dec 16 13:16:02 GMT 2023 , Edited by admin on Sat Dec 16 13:16:02 GMT 2023

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