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Details

Stereochemistry ACHIRAL
Molecular Formula C7H16O3
Molecular Weight 148.2001
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Butylidynetrimethanol

SMILES

CCCC(CO)(CO)CO

InChI

InChIKey=SZSSMFVYZRQGIM-UHFFFAOYSA-N
InChI=1S/C7H16O3/c1-2-3-7(4-8,5-9)6-10/h8-10H,2-6H2,1H3

HIDE SMILES / InChI

Molecular Formula C7H16O3
Molecular Weight 148.2001
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 12:01:30 GMT 2023
Edited
by admin
on Sat Dec 16 12:01:30 GMT 2023
Record UNII
S5Z4UV3PFW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Butylidynetrimethanol
Systematic Name English
2-(Hydroxymethyl)-2-propyl-1,3-propanediol
Systematic Name English
1,3-Propanediol, 2-(hydroxymethyl)-2-propyl-
Systematic Name English
2-(hydroxymethyl)-2-propylpropane-1,3-diol
Systematic Name English
NSC-97516
Code English
Code System Code Type Description
CAS
7426-71-3
Created by admin on Sat Dec 16 12:01:30 GMT 2023 , Edited by admin on Sat Dec 16 12:01:30 GMT 2023
PRIMARY
PUBCHEM
81928
Created by admin on Sat Dec 16 12:01:30 GMT 2023 , Edited by admin on Sat Dec 16 12:01:30 GMT 2023
PRIMARY
ECHA (EC/EINECS)
231-065-5
Created by admin on Sat Dec 16 12:01:30 GMT 2023 , Edited by admin on Sat Dec 16 12:01:30 GMT 2023
PRIMARY
FDA UNII
S5Z4UV3PFW
Created by admin on Sat Dec 16 12:01:30 GMT 2023 , Edited by admin on Sat Dec 16 12:01:30 GMT 2023
PRIMARY
EPA CompTox
DTXSID10225267
Created by admin on Sat Dec 16 12:01:30 GMT 2023 , Edited by admin on Sat Dec 16 12:01:30 GMT 2023
PRIMARY
NSC
97516
Created by admin on Sat Dec 16 12:01:30 GMT 2023 , Edited by admin on Sat Dec 16 12:01:30 GMT 2023
PRIMARY