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17407-55-5

17407-55-5 Structure

17407-55-5 Structure
IdentificationMore
[Name]

(S)-(+)-2-HYDROXY-3-METHYLBUTYRIC ACID
[CAS]

17407-55-5
[Synonyms]

2-HYDROXY-3-METHYLBUTYRIC ACID
2S-HYDROXY-3-METHYL-BUTANOIC ACID
3-METHYL-2-HYDROXY-BUTANOIC ACID
L-ALPHA-HYDROXYISOVALERIC ACID
(S)-(+)-2-HYDROXY-3-METHYLBUTANOIC ACID
(S)-(+)-2-HYDROXY-3-METHYLBUTYRIC ACID
(S)-2-HYDROXY-3-METHYLBUTYRIC ACID
(S)-(+)-2-HYDROXY-3-METHYLBUTYRIC ACID, 99% (99% EE/GLC)
(S)-(+)-2-Hydroxy-3-methylbutanoic acid, 99+%
l-α-hydroxyisovaleric acid
(2R)-2-Hydroxy-3-methylbutanoic acid 97%
L-Valic acid
L-a-Hydroxyisovaleric acid
(2S)-2-Hydroxy-3-methylbutyric acid
(2S)-2-Hydroxyisovaleric acid
(S)-3-Methyl-2-hydroxybutyric acid
[EINECS(EC#)]

605-704-7
[Molecular Formula]

C5H10O3
[MDL Number]

MFCD00066443
[Molecular Weight]

118.13
[MOL File]

17407-55-5.mol
Chemical PropertiesBack Directory
[Appearance]

white fine crystalline powder
[Melting point ]

68-70 °C (lit.)
[Boiling point ]

124-125 °C/13 mmHg (lit.)
[density ]

1.136
[refractive index ]

1.4641 (estimate)
[Fp ]

112℃
[storage temp. ]

2-8°C
[solubility ]

DMF: 30 mg/ml; DMSO: 30 mg/ml; Ethanol: 30 mg/ml; PBS (pH 7.2): 10 mg/ml
[form ]

Powder
[pka]

3.87±0.16(Predicted)
[color ]

White
[Optical Rotation]

[α]20/D +19°, c = 1 in chloroform
[BRN ]

1721140
[InChI]

1S/C5H10O3/c1-3(2)4(6)5(7)8/h3-4,6H,1-2H3,(H,7,8)/t4-/m0/s1
[InChIKey]

NGEWQZIDQIYUNV-BYPYZUCNSA-N
[SMILES]

CC(C)[C@H](O)C(O)=O
[CAS DataBase Reference]

17407-55-5(CAS DataBase Reference)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P264-P271-P280-P302+P352-P305+P351+P338
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
[WGK Germany ]

3
[F ]

3-10
[Hazard Note ]

Irritant
[HS Code ]

29181990
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Sulfuric acid-->Sodium nitrite-->Ammonium sulfate-->L-Valine
Hazard InformationBack Directory
[Chemical Properties]

white fine crystalline powder
[Uses]

A useful chiral building block for peptide synthesis. Used in the preparation of the cytotoxic didemnin cyclopeptides and of the antineoplastic agent dolastatin 15.
[Definition]

ChEBI: (S)-2-hydroxy-3-methylbutyric acid is the S-enantiomer of 2-hydroxy-3-methylbutyric acid. It is used as a chiral building block for peptide synthesis. It has a role as a chiral reagent and a human metabolite. It is a conjugate acid of a (S)-2-hydroxy-3-methylbutyrate. It is an enantiomer of a (R)-2-hydroxy-3-methylbutyric acid.
Spectrum DetailBack Directory
[Spectrum Detail]

(S)-(+)-2-HYDROXY-3-METHYLBUTYRIC ACID(17407-55-5)1HNMR
(S)-(+)-2-HYDROXY-3-METHYLBUTYRIC ACID(17407-55-5)Raman
(S)-(+)-2-HYDROXY-3-METHYLBUTYRIC ACID(17407-55-5)IR
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

(S)-(+)-2-Hydroxy-3-methylbutanoic acid, 99+%(17407-55-5)
[Sigma Aldrich]

17407-55-5(sigmaaldrich)
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