4-ACETYL-4-METHYLHEPTANEDIOIC ACID

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H16O5
Molecular Weight	216.231
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-ACETYL-4-METHYLHEPTANEDIOIC ACID

Structure Search

SMILES

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

InChI

InChIKey=LYBQMKJABQTTFJ-UHFFFAOYSA-N

InChI=1S/C10H16O5/c1-7(11)10(2,5-3-8(12)13)6-4-9(14)15/h3-6H2,1-2H3,(H,12,13)(H,14,15)

HIDE SMILES / InChI

Molecular Formula	C10H16O5
Molecular Weight	216.231
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 19:30:12 GMT 2025` Edited by `admin` on `Tue Apr 01 19:30:12 GMT 2025`
Record UNII	AAV2YTM2MI
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

4-ACETYL-4-METHYLHEPTANEDIOIC ACID

Systematic Name

English

NSC-8128

Preferred Name

English

HEPTANEDIOIC ACID, 4-ACETYL-4-METHYL-

Systematic Name

English

Code System Code Type Description

FDA UNII

AAV2YTM2MI

Created by admin on Tue Apr 01 19:30:12 GMT 2025 , Edited by admin on Tue Apr 01 19:30:12 GMT 2025

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CAS

5460-06-0

Created by admin on Tue Apr 01 19:30:12 GMT 2025 , Edited by admin on Tue Apr 01 19:30:12 GMT 2025

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NSC

8128

Created by admin on Tue Apr 01 19:30:12 GMT 2025 , Edited by admin on Tue Apr 01 19:30:12 GMT 2025

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PUBCHEM

407651

Created by admin on Tue Apr 01 19:30:12 GMT 2025 , Edited by admin on Tue Apr 01 19:30:12 GMT 2025

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EPA CompTox

DTXSID20203031

Created by admin on Tue Apr 01 19:30:12 GMT 2025 , Edited by admin on Tue Apr 01 19:30:12 GMT 2025

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