(S)-3-Butene-1,2-diol supplier

Name
3-BUTENE-1,2-DIOL
EINECS 207-835-1
CAS No. 62214-39-5
Article Data2
CAS DataBase
Density 1.053g/cm³
Solubility
Melting Point
Formula C₄H₈O₂
Boiling Point 196.5 °C at 760 mmHg
Molecular Weight 88.1063
Flash Point 89.3 °C
Transport Information
Appearance
Safety S36-S26
Risk Codes R36/37/38
Molecular Structure
Hazard Symbols
Synonyms 3-Butene-1,2-diol,(S)-;(2S)-3-Butene-1,2-diol;(S)-3-Butene-1,2-diol;
PSA 40.46000
LogP -0.47440

(S)-3-Butene-1,2-diol Specification

The (S)-3-Butene-1,2-diol with cas registry number of 62214-39-5, belongs to the following product categories: (1)Chiral Building Blocks; (2)Organic Building Blocks; (3)Polyols. It has the systematic name of (2S)-but-3-ene-1,2-diol. And it is also named (2S)-But-3-ene-1,2-diol. Its refractive index is 1.461.

Physical properties about this chemical are: (1)ACD/LogP: -0.79; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 18.46 Å²; (7)Index of Refraction: 1.46; (8)Molar Refractivity: 23.33 cm³; (9)Molar Volume: 85 cm³; (10)Polarizability: 9.25×10^-24cm³; (11)Surface Tension: 37.9 dyne/cm; (12)Enthalpy of Vaporization: 50.35 kJ/mol; (13)Vapour Pressure: 0.102 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
The (S)-3-Butene-1,2-diol irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: O[C@@H](\C=C)CO;
(2)InChI: InChI=1/C4H8O2/c1-2-4(6)3-5/h2,4-6H,1,3H2/t4-/m0/s1;
(3)InChIKey: ITMIAZBRRZANGB-BYPYZUCNBO;
(4)Std. InChI: InChI=1S/C4H8O2/c1-2-4(6)3-5/h2,4-6H,1,3H2/t4-/m0/s1;
(5)Std. InChIKey: ITMIAZBRRZANGB-BYPYZUCNSA-N

Product Name

3-BUTENE-1,2-DIOL

(S)-3-Butene-1,2-diol Specification

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