UCSF

ZINC00389853

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 15th, 2005 8 Yes

Popular Name: (S)-(+)-2-Hydroxy-3-methylbutyric acid (S)-(+)-2-Hydroxy-3-methylbutyri…

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CAS Numbers: 15071-34-8 , 17407-55-5 , 4026-18-0 , 600-37-3 , [17407-56-6] , [4026-18-0]

Other Names:

"(S)-(+)-2-Hydroxy-3-methylbutyric acid, 98%"

(2S)-Hydroxy-3-methyl-butyric acid

(S)-()-2-Hydroxy-3-methylbutyric acid; L-alpha-Hydroxyisovaleric acid; bmse000570

(S)-(+)-2-Hydroxy-3-methylbutanoic acid, 99+%

(S)-(+)-2-hydroxy-3-methylbutanoic acid; (S)-(+)-2-hydroxy-3-methylbutyric acid; 2-Hydroxyisovalerate; 2-Oxyisovalerate; 2-hydroxy-3-methyl-(S)-(+)-butyric acid; A-hydroxyisovaleric acid; L-(+)-2-hydroxyisovaleric acid; L-(+)-alpha-hydroxyisovaleric acid

(S)-(+)-2-Hydroxy-3-methylbutyricacid

(S)-2-Hydroxy-3-methylbutanoic acid

(S)-2-hydroxy-3-methylbutyrate

(S)-2-hydroxy-3-methylbutyric acid

2-Hydroxy-3-methyl butyric acid

2-hydroxy-3-methyl-butanoic acid

2-hydroxy-3-methyl-butyric acid

2-hydroxy-3-methyl-Butyric acid; 2-Hydroxy-3-methylbutanoate; 2-Hydroxy-3-methylbutanoic acid; 2-Hydroxy-3-methylbutyrate; 2-Hydroxyisopentanoate; 2-Hydroxyisopentanoic acid; 2-Hydroxyisovalerate; 2-Hydroxyisovaleric acid; 2-Oxyisovalerate; 2-Oxyisovaleri

2-Hydroxy-3-methyl-Butyric acid;2-Hydroxy-3-methylbutanoate;2-Hydroxy-3-methylbutanoic acid;2-Hydroxy-3-methylbutyrate;2-Hydroxyisopentanoate;2-Hydroxyisopentanoic acid;2-Hydroxyisovalerate;2-Hydroxyisovaleric acid;2-Oxyisovalerate;2-Oxyisovaleric acid;3-

2-Hydroxy-3-methylbutanoic acid

2-hydroxy-3-methylbutyrate

2-Hydroxy-3-methylbutyrate; 2-Hydroxyisopentanoate; 2-Hydroxyisovalerate; 2-Oxyisovalerate; 3-Methyl-2-hydroxybutyrate; A-hydroxyisovalerate; DL-2-Hydroxy-3-methylbutanoate; DL-2-Hydroxyisovalerate; DL-a-hydroxyisovalerate; DL-alpha-hydroxyisovalerate; al

2-Hydroxy-3-methylbutyric acid

2-Hydroxy-3-methylbutyric acid, 98%

2-Hydroxy-3-methylbutyricAcid

2-Hydroxyisovalerate; 2-Oxyisovalerate

2S-hydroxy-3-methyl-butanoic acid

CHEBI:606519

D-Alpha-hydroxyisovaleric acid

MFCD00004242

MFCD00066442

MFCD00066443

n / a

OR-1261

QB-8181

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.04 0.88 -42.6 1 3 -1 60 117.124 2 ↓

Vendor Notes

Note Type Comments Provided By
Mp [°C] 65 - 68 Acros Organics
Melting_Point 82-84? Alfa-Aesar
H phrase H315: Causes skin irritation Acros Organics
H phrase H315: Causes skin irritation; H319: Causes serious eye irritation; H335: May cause respiratory irritation Acros Organics
P phrase P261: Avoid breathing dust/fume/gas/mist/vapors/spray Acros Organics
P phrase P261: Avoid breathing dust/fume/gas/mist/vapors/spray; P302+ P352: IF ON SKIN: Wash with plenty of soap and water; P280: Wear protective gloves/protective clothing/eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water Acros Organics
R phrase R36/37/38: Irritating to eyes, respiratory system and skin. Acros Organics
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics
Hazard XI: Irritant Acros Organics

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Analogs ( Draw Identity 99% 90% 80% 70% )