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Details

Stereochemistry ACHIRAL
Molecular Formula C8H18O3
Molecular Weight 162.2267
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TRIMETHYL ORTHOVALERATE

SMILES

CCCCC(OC)(OC)OC

InChI

InChIKey=XUXVVQKJULMMKX-UHFFFAOYSA-N
InChI=1S/C8H18O3/c1-5-6-7-8(9-2,10-3)11-4/h5-7H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C8H18O3
Molecular Weight 162.2267
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Experimental and theoretical studies of the homogeneous, unimolecular gas-phase elimination kinetics of trimethyl orthovalerate and trimethyl orthochloroacetate.
2010 Apr 1
Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 02:24:31 GMT 2023
Edited
by admin
on Sat Dec 16 02:24:31 GMT 2023
Record UNII
W0X9MOM6VZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TRIMETHYL ORTHOVALERATE
MI  
Systematic Name English
METHYL ORTHOVALERATE
Systematic Name English
TRIMETHYL ORTHOVALERATE [MI]
Common Name English
PENTANE, 1,1,1-TRIMETHOXY-
Systematic Name English
ORTHOVALERIC ACID, TRIMETHYL ESTER
Common Name English
1,1,1-TRIMETHOXYPENTANE
Systematic Name English
Code System Code Type Description
CAS
13820-09-2
Created by admin on Sat Dec 16 02:24:31 GMT 2023 , Edited by admin on Sat Dec 16 02:24:31 GMT 2023
PRIMARY
FDA UNII
W0X9MOM6VZ
Created by admin on Sat Dec 16 02:24:31 GMT 2023 , Edited by admin on Sat Dec 16 02:24:31 GMT 2023
PRIMARY
PUBCHEM
83755
Created by admin on Sat Dec 16 02:24:31 GMT 2023 , Edited by admin on Sat Dec 16 02:24:31 GMT 2023
PRIMARY
ECHA (EC/EINECS)
237-496-5
Created by admin on Sat Dec 16 02:24:31 GMT 2023 , Edited by admin on Sat Dec 16 02:24:31 GMT 2023
PRIMARY
MERCK INDEX
m11158
Created by admin on Sat Dec 16 02:24:31 GMT 2023 , Edited by admin on Sat Dec 16 02:24:31 GMT 2023
PRIMARY Merck Index
EPA CompTox
DTXSID4065654
Created by admin on Sat Dec 16 02:24:31 GMT 2023 , Edited by admin on Sat Dec 16 02:24:31 GMT 2023
PRIMARY