2,2,4-Trimethylpentane-1,3-diyl diformate

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

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C10H18O4
Molecular Weight	202.2475
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2,2,4-Trimethylpentane-1,3-diyl diformate

Structure Search

SMILES

CC(C)C(OC=O)C(C)(C)COC=O

InChI

InChIKey=JJSQUEVEQCZSTG-UHFFFAOYSA-N

InChI=1S/C10H18O4/c1-8(2)9(14-7-12)10(3,4)5-13-6-11/h6-9H,5H2,1-4H3

HIDE SMILES / InChI

Molecular Formula	C10H18O4
Molecular Weight	202.2475
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 10:28:09 GMT 2025` Edited by `admin` on `Wed Apr 02 10:28:09 GMT 2025`
Record UNII	8JFJ3CN5C8
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

AI3-30492

Preferred Name

English

2,2,4-Trimethylpentane-1,3-diyl diformate

Systematic Name

English

NSC-21837

Code

English

1,3-Pentanediol, 2,2,4-trimethyl-, diformate

Systematic Name

English

(3-Formyloxy-2,2,4-trimethylpentyl) formate

Systematic Name

English

Code System Code Type Description

FDA UNII

8JFJ3CN5C8

Created by admin on Wed Apr 02 10:28:09 GMT 2025 , Edited by admin on Wed Apr 02 10:28:09 GMT 2025

PRIMARY

CAS

5451-59-2

Created by admin on Wed Apr 02 10:28:09 GMT 2025 , Edited by admin on Wed Apr 02 10:28:09 GMT 2025

PRIMARY

EPA CompTox

DTXSID401237468

Created by admin on Wed Apr 02 10:28:09 GMT 2025 , Edited by admin on Wed Apr 02 10:28:09 GMT 2025

PRIMARY

PUBCHEM

95569

Created by admin on Wed Apr 02 10:28:09 GMT 2025 , Edited by admin on Wed Apr 02 10:28:09 GMT 2025

PRIMARY

NSC

21837

Created by admin on Wed Apr 02 10:28:09 GMT 2025 , Edited by admin on Wed Apr 02 10:28:09 GMT 2025

PRIMARY