(S)-2-Chloro-3-methylbutyric acid supplier

Name
(S)-2-CHLORO-3-METHYLBUTYRIC ACID
EINECS
CAS No. 26782-74-1
Article Data26
CAS DataBase
Density 1.159 g/cm³
Solubility
Melting Point
Formula C₅H₉ClO₂
Boiling Point 210.328 °C at 760 mmHg
Molecular Weight 136.578
Flash Point 81.004 °C
Transport Information UN 3265
Appearance
Safety 26-36/37/39-45
Risk Codes 34
Molecular Structure
Hazard Symbols C
Synonyms Butanoicacid, 2-chloro-3-methyl-, (S)-;Butyric acid, 2-chloro-3-methyl-, (S)- (8CI);(S)-(+)-2-Chloro-3-methylbutanoic acid;(S)-2-Chloro-3-methylbutanoic acid;
PSA 37.30000
LogP 1.33440

(S)-2-Chloro-3-methylbutyric acid Specification

This chemical is called Butanoic acid, 2-chloro-3-methyl-, (2S)-, and its CAS registry number is 26782-74-1. With the molecular formula of C₅H₉ClO₂, its product categories are Building Blocks for Liquid Crystals; Carboxylic Acids (Chiral); Chiral Building Blocks; Chiral Compounds (Building Blocks for Liquid Crystals); Functional Materials; Synthetic Organic Chemistry. In addition, it should be stored at 2-8 °C.

Other characteristics of the Butanoic acid, 2-chloro-3-methyl-, (2S)- can be summarised as followings: (1)ACD/LogP: 1.18; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.28; (4)ACD/LogD (pH 7.4): -2.48; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 26.3 Å²; (13)Index of Refraction: 1.447; (14)Molar Refractivity: 31.54 cm³; (15)Molar Volume: 117.8 cm³; (16)Polarizability: 12.5×10^-24cm³; (17)Surface Tension: 34.7 dyne/cm; (18)Density: 1.159 g/cm³; (19)Flash Point: 81 °C; (20)Enthalpy of Vaporization: 49.22 kJ/mol; (21)Boiling Point: 210.3 °C at 760 mmHg; (22)Vapour Pressure: 0.0768 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following: This chemical causes burns. You should wear suitable protective clothing to avoid contacting with skin and eyes. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
1.SMILES: Cl[C@H](C(=O)O)C(C)C
2.InChI: InChI=1/C5H9ClO2/c1-3(2)4(6)5(7)8/h3-4H,1-2H3,(H,7,8)/t4-/m0/s1
3.InChIKey: DDTJFSPKEIAZAM-BYPYZUCNBT

Product Name

(S)-2-CHLORO-3-METHYLBUTYRIC ACID

(S)-2-Chloro-3-methylbutyric acid Specification

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