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(-)-2-Hydroxy-3-methylbutyric acid

IUPAC: (2R)-2-hydroxy-3-methylbutanoic acid

CAS 17407-56-6
C5H10O3

(-)-2-Hydroxy-3-methylbutyric acid (CAS 17407-56-6) is a chemical compound with molecular formula C5H10O3 and molecular weight 118.13 g/mol . GHS signal word: Warning. Hazard classifications: Health Hazard.

What is (-)-2-Hydroxy-3-methylbutyric acid?

Molecular Formula
C5H10O3
Molecular Weight
118.13 g/mol

Description

(R)-2-hydroxy-3-methylbutyric acid is the R-enantiomer of 2-hydroxy-3-methylbutyric acid. It is functionally related to a D-valine. It is a conjugate acid of a (R)-2-hydroxy-3-methylbutyrate. It is an enantiomer of a (S)-2-hydroxy-3-methylbutyric acid.

Structure Identifiers

SMILES
CC(C)[C@H](C(=O)O)O
InChI
InChI=1S/C5H10O3/c1-3(2)4(6)5(7)8/h3-4,6H,1-2H3,(H,7,8)/t4-/m1/s1
InChIKey
NGEWQZIDQIYUNV-SCSAIBSYSA-N

Properties

Computed

Calculated molecular descriptors used in drug design and computational chemistry.

Exact Mass
118.0630 Da
XLogP
0.50
TPSA
57.5 Ų
H-Bond Donors
2
H-Bond Acceptors
3
Complexity
88
Formal Charge
0

Safety information

Signal Word

Warning

GHS Pictograms

GHS pictogram: Health Hazard GHS07

Hazard Statements

  • H315 Causes skin irritation

Precautionary Statements

  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray
  • P264 Wash thoroughly after handling
  • P271 Use only outdoors or in a well-ventilated area
  • P280 Wear protective gloves/protective clothing/eye protection/face protection
  • P302+P352 IF ON SKIN: Wash with soap and water
  • P304+P340 IF INHALED: Remove victim to fresh air and keep at rest in a position comfortable for breathing
  • P305+P351+P338 IF IN EYES: Rinse continuously with water for several minutes. Remove contact lenses if present and easy to do, continue rinsing
  • P321 Specific treatment (see supplemental first aid instructions on this label)
  • P403+P233 Store in a well-ventilated place. Keep container tightly closed
  • P405 Store locked up
  • P501 Dispose of contents/container to an approved waste disposal plant

Synonyms (48)

  • s12088
  • F066615
  • FH48551
  • AS-12128
  • CS-B0167
  • SY041974
  • Q27120649
  • SBB053572
  • 17407-56-6
  • IDC1ORH8V7
  • CHEBI:46415
  • BDBM50412186
  • D-Valic acid
  • EN300-115017
  • MFCD00066442
  • AKOS006377804
  • CHEMBL1162481
  • SCHEMBL426205
  • RefChem:473464
  • DTXSID001360093
  • UNII-IDC1ORH8V7
  • DEAMINOHYDROXYVALINE
  • D--Hydroxyisovaleric acid
  • d-2-hydroxyisovaleric acid
  • D-|A-Hydroxyisovaleric acid
  • (-)-2-Hydroxyisovaleric acid
  • (R)-2-hydroxyisovaleric acid
  • 2-Hydroxyisovaleric acid, (R)-
  • D-alpha-Hydroxyisovaleric acid
  • (-)-alpha-Hydroxyisovaleric acid
  • (R)-(-)-2-Hydroxyisovaleric acid
  • D- alpha -Hydroxyisovaleric acid
  • D-.ALPHA.-HYDROXYISOVALERIC ACID
  • d-2-hydroxy-3-methylbutyric acid
  • (-)-.ALPHA.-HYDROXYISOVALERIC ACID
  • (-)-2-Hydroxy-3-methylbutyric acid
  • (R)-2-Hydroxy-3-methylbutyric acid
  • (R)-2-hydroxy-3-methyl-butyric acid
  • (R)-2-hydroxy-3-methylbutanoic acid
  • (2R)-2-hydroxy-3-methylbutanoic acid
  • (2R)-3-Methyl-2-hydroxybutanoic acid
  • 2-hydroxyisovaleric acid, (R)-isomer
  • (2R)-2-hydroxy-3-methyl-butanoic acid
  • Butyric acid, 2-hydroxy-3-methyl-, D-
  • Butanoic acid,2-hydroxy-3-methyl-,(2S)-
  • Butanoic acid, 2-hydroxy-3-methyl-, (R)-
  • Butanoic acid, 2-hydroxy-3-methyl-, (2R)-
  • D-alpha-Hydroxyisovaleric acid, >=98.0% (T)

Frequently asked questions

What is the CAS number of (-)-2-Hydroxy-3-methylbutyric acid?

The CAS Registry Number for (-)-2-Hydroxy-3-methylbutyric acid is 17407-56-6.

What is the IUPAC name of (-)-2-Hydroxy-3-methylbutyric acid?

The IUPAC name of (-)-2-Hydroxy-3-methylbutyric acid is (2R)-2-hydroxy-3-methylbutanoic acid.

What is the molecular formula of (-)-2-Hydroxy-3-methylbutyric acid?

(-)-2-Hydroxy-3-methylbutyric acid has the molecular formula C5H10O3 and a molecular weight of 118.13 g/mol.

What is the SMILES notation for (-)-2-Hydroxy-3-methylbutyric acid?

The SMILES notation for (-)-2-Hydroxy-3-methylbutyric acid is CC(C)[C@H](C(=O)O)O.

Is (-)-2-Hydroxy-3-methylbutyric acid hazardous?

(-)-2-Hydroxy-3-methylbutyric acid carries the following GHS hazard classifications: Health Hazard. Signal word: Warning.

What are other names for (-)-2-Hydroxy-3-methylbutyric acid?

(-)-2-Hydroxy-3-methylbutyric acid is also known as (-)-.ALPHA.-HYDROXYISOVALERIC ACID, (-)-2-Hydroxy-3-methylbutyric acid, (-)-2-Hydroxyisovaleric acid, (-)-alpha-Hydroxyisovaleric acid, (2R)-2-hydroxy-3-methyl-butanoic acid.

Data sourced from PubChem CID 5289545. Last updated .

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