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Details

Stereochemistry RACEMIC
Molecular Formula C9H14O3
Molecular Weight 170.2057
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(3-FURANYL)-1,4-PENTANEDIOL, (1R,4R)-(±)-

SMILES

C[C@@H](O)CC[C@@H](O)C1=COC=C1

InChI

InChIKey=AORCXYMSPVAQIZ-VXNVDRBHSA-N
InChI=1S/C9H14O3/c1-7(10)2-3-9(11)8-4-5-12-6-8/h4-7,9-11H,2-3H2,1H3/t7-,9-/m1/s1

HIDE SMILES / InChI

Molecular Formula C9H14O3
Molecular Weight 170.2057
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 23:23:51 GMT 2025
Edited
by admin
on Mon Mar 31 23:23:51 GMT 2025
Record UNII
10STG06H5U
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,4-PENTANEDIOL, 1-(3-FURANYL)-, (1R,4R)-REL-
Preferred Name English
1-(3-FURANYL)-1,4-PENTANEDIOL, (1R,4R)-(±)-
Systematic Name English
1,4-PENTANEDIOL, 1-(3-FURANYL)-, (R*,R*)-(±)-
Systematic Name English
1,4-PENTANEDIOL, 1-(3-FURANYL)-, (R*,R*)-
Systematic Name English
Code System Code Type Description
FDA UNII
10STG06H5U
Created by admin on Mon Mar 31 23:23:51 GMT 2025 , Edited by admin on Mon Mar 31 23:23:51 GMT 2025
PRIMARY
CAS
119136-24-2
Created by admin on Mon Mar 31 23:23:51 GMT 2025 , Edited by admin on Mon Mar 31 23:23:51 GMT 2025
PRIMARY
PUBCHEM
119058003
Created by admin on Mon Mar 31 23:23:51 GMT 2025 , Edited by admin on Mon Mar 31 23:23:51 GMT 2025
PRIMARY