U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C11H22O3
Molecular Weight 202.2906
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,1-Dibutoxyacetone

SMILES

CCCCOC(OCCCC)C(C)=O

InChI

InChIKey=HCSCGYDLFNSHLE-UHFFFAOYSA-N
InChI=1S/C11H22O3/c1-4-6-8-13-11(10(3)12)14-9-7-5-2/h11H,4-9H2,1-3H3

HIDE SMILES / InChI

Approval Year

Name Type Language
1,1-Dibutoxyacetone
Systematic Name English
NSC-158339
Code English
Pyruvaldehyde, 1-(dibutyl acetal)
Systematic Name English
1,1-Dibutoxy-2-propanone
Systematic Name English
Pyruvaldehyde, dibutyl acetal
Systematic Name English
2-Propanone, 1,1-dibutoxy-
Systematic Name English
Code System Code Type Description
PUBCHEM
87991
Created by admin on Sat Dec 16 12:19:58 GMT 2023 , Edited by admin on Sat Dec 16 12:19:58 GMT 2023
PRIMARY
ECHA (EC/EINECS)
242-921-2
Created by admin on Sat Dec 16 12:19:58 GMT 2023 , Edited by admin on Sat Dec 16 12:19:58 GMT 2023
PRIMARY
CAS
19255-82-4
Created by admin on Sat Dec 16 12:19:58 GMT 2023 , Edited by admin on Sat Dec 16 12:19:58 GMT 2023
PRIMARY
FDA UNII
N7H8EWY8ED
Created by admin on Sat Dec 16 12:19:58 GMT 2023 , Edited by admin on Sat Dec 16 12:19:58 GMT 2023
PRIMARY
EPA CompTox
DTXSID10172848
Created by admin on Sat Dec 16 12:19:58 GMT 2023 , Edited by admin on Sat Dec 16 12:19:58 GMT 2023
PRIMARY
NSC
158339
Created by admin on Sat Dec 16 12:19:58 GMT 2023 , Edited by admin on Sat Dec 16 12:19:58 GMT 2023
PRIMARY