4-Acetyl-4-isopropylheptanedioic acid

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C12H20O5
Molecular Weight	244.2842
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-Acetyl-4-isopropylheptanedioic acid

Structure Search

SMILES

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

InChI

InChIKey=ZVBXFUQCILFFPH-UHFFFAOYSA-N

InChI=1S/C12H20O5/c1-8(2)12(9(3)13,6-4-10(14)15)7-5-11(16)17/h8H,4-7H2,1-3H3,(H,14,15)(H,16,17)

HIDE SMILES / InChI

Molecular Formula	C12H20O5
Molecular Weight	244.2842
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 12:57:28 GMT 2023` Edited by `admin` on `Sat Dec 16 12:57:28 GMT 2023`
Record UNII	23CF7U4PC2
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

4-Acetyl-4-isopropylheptanedioic acid

Systematic Name

English

Heptanedioic acid, 4-acetyl-4-(1-methylethyl)-

Systematic Name

English

NSC-11020

Code

English

4-Acetyl-4-(1-methylethyl)heptanedioic acid

Systematic Name

English

Code System Code Type Description

PUBCHEM

223394

Created by admin on Sat Dec 16 12:57:28 GMT 2023 , Edited by admin on Sat Dec 16 12:57:28 GMT 2023

PRIMARY

CAS

6279-92-1

Created by admin on Sat Dec 16 12:57:28 GMT 2023 , Edited by admin on Sat Dec 16 12:57:28 GMT 2023

PRIMARY

FDA UNII

23CF7U4PC2

Created by admin on Sat Dec 16 12:57:28 GMT 2023 , Edited by admin on Sat Dec 16 12:57:28 GMT 2023

PRIMARY

NSC

11020

Created by admin on Sat Dec 16 12:57:28 GMT 2023 , Edited by admin on Sat Dec 16 12:57:28 GMT 2023

PRIMARY

EPA CompTox

DTXSID10211867

Created by admin on Sat Dec 16 12:57:28 GMT 2023 , Edited by admin on Sat Dec 16 12:57:28 GMT 2023

PRIMARY