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Details

Stereochemistry MIXED
Molecular Formula C6H10O2
Molecular Weight 114.1424
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HEX-3-YNE-2,5-DIOL

SMILES

CC(O)C#CC(C)O

InChI

InChIKey=KDOWHHULNTXTNS-UHFFFAOYSA-N
InChI=1S/C6H10O2/c1-5(7)3-4-6(2)8/h5-8H,1-2H3

HIDE SMILES / InChI

Molecular Formula C6H10O2
Molecular Weight 114.1424
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:37:58 GMT 2023
Edited
by admin
on Sat Dec 16 11:37:58 GMT 2023
Record UNII
538TMM2U3G
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
HEX-3-YNE-2,5-DIOL
Systematic Name English
NSC-409184
Code English
HEXYNE-3-DIOL-2,5
Common Name English
J49.444E
Code English
3-HEXYNE-2,5-DIOL
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID3044910
Created by admin on Sat Dec 16 11:37:58 GMT 2023 , Edited by admin on Sat Dec 16 11:37:58 GMT 2023
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NSC
409184
Created by admin on Sat Dec 16 11:37:58 GMT 2023 , Edited by admin on Sat Dec 16 11:37:58 GMT 2023
PRIMARY
CAS
3031-66-1
Created by admin on Sat Dec 16 11:37:58 GMT 2023 , Edited by admin on Sat Dec 16 11:37:58 GMT 2023
PRIMARY
ECHA (EC/EINECS)
221-209-5
Created by admin on Sat Dec 16 11:37:58 GMT 2023 , Edited by admin on Sat Dec 16 11:37:58 GMT 2023
PRIMARY
PUBCHEM
18198
Created by admin on Sat Dec 16 11:37:58 GMT 2023 , Edited by admin on Sat Dec 16 11:37:58 GMT 2023
PRIMARY
FDA UNII
538TMM2U3G
Created by admin on Sat Dec 16 11:37:58 GMT 2023 , Edited by admin on Sat Dec 16 11:37:58 GMT 2023
PRIMARY