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Details

Stereochemistry ABSOLUTE
Molecular Formula C5H12O2
Molecular Weight 104.1476
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-METHYL-1,2-BUTANEDIOL, (2R)-

SMILES

CC(C)[C@@H](O)CO

InChI

InChIKey=HJJZIMFAIMUSBW-YFKPBYRVSA-N
InChI=1S/C5H12O2/c1-4(2)5(7)3-6/h4-7H,3H2,1-2H3/t5-/m0/s1

HIDE SMILES / InChI

Molecular Formula C5H12O2
Molecular Weight 104.1476
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:45:02 GMT 2023
Edited
by admin
on Sat Dec 16 18:45:02 GMT 2023
Record UNII
ZC37U9R3J1
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-METHYL-1,2-BUTANEDIOL, (2R)-
Systematic Name English
1,2-BUTANEDIOL, 3-METHYL-, (R)-(-)-
Systematic Name English
3-METHYLBUTANE-1,2-DIOL, (2R)-
Systematic Name English
(R)-3-METHYLBUTANE-1,2-DIOL
Systematic Name English
1,2-BUTANEDIOL, 3-METHYL-, (2R)-
Systematic Name English
1,2-BUTANEDIOL, 3-METHYL-, (R)-
Systematic Name English
3-METHYL-1,2-BUTANEDIOL, (-)-
Systematic Name English
Code System Code Type Description
PUBCHEM
13289080
Created by admin on Sat Dec 16 18:45:02 GMT 2023 , Edited by admin on Sat Dec 16 18:45:02 GMT 2023
PRIMARY
CAS
31612-62-1
Created by admin on Sat Dec 16 18:45:02 GMT 2023 , Edited by admin on Sat Dec 16 18:45:02 GMT 2023
PRIMARY
FDA UNII
ZC37U9R3J1
Created by admin on Sat Dec 16 18:45:02 GMT 2023 , Edited by admin on Sat Dec 16 18:45:02 GMT 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER