CAS No.22644-28-6,(R)-2-Methyl-1,4-butanediol Suppliers

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Basic Information

Molecular Structure:
CAS No.:	22644-28-6
Name:	(R)-2-Methyl-1,4-butanediol
Article Data:	28

Formula:	C₅H₁₂O₂
Molecular Weight:	104.149
Synonyms:	1,4-Butanediol,2-methyl-, (R)-;1,4-Butanediol, 2-methyl-, (R)-(+)- (8CI);(R)-2-Methyl-1,4-butanediol;(2R)-2-Methylbutane-1,4-diol;(R)-(+)-2-Methyl-1,4-butanediol;(R)-2-Methyl-1,4-butanediol;
Density:	0.978 g/cm³
Boiling Point:	212.2 °C at 760 mmHg
Flash Point:	98.9 °C
PSA:	40.46000
LogP:	-0.00280

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Specification

The (R)-2-Methyl-1,4-butanediol with CAS registry number of 22644-28-6 is also known as 1,4-Butanediol,2-methyl-, (R)-. The IUPAC name is 2-Methylbutane-1,4-diol. It belongs to product categories of Chiral Building Blocks; Glycidyl Compounds, etc. (Chiral); Synthetic Organic Chemistry; Chiral Building Blocks; Organic Building Blocks; Polyols. In addition, the formula is C₅H₁₂O₂ and the molecular weight is 104.15. This chemical should be stored in cool and dry place away from oxides.

Physical properties about (R)-2-Methyl-1,4-butanediol are: (1)ACD/LogP: -0.68; (2)ACD/LogD (pH 5.5): -0.68; (3)ACD/LogD (pH 7.4): -0.68; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 10.22; (7)ACD/KOC (pH 7.4): 10.22; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 5; (11)Index of Refraction: 1.443; (12)Molar Refractivity: 28.24 cm³; (13)Molar Volume: 106.4 cm³; (14)Surface Tension: 36.6 dyne/cm; (15)Density: 0.978 g/cm³; (16)Flash Point: 98.9 °C; (17)Enthalpy of Vaporization: 52.17 kJ/mol; (18)Boiling Point: 212.2 °C at 760 mmHg; (19)Vapour Pressure: 0.0392 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
1. Canonical SMILES: CC(CCO)CO
2. InChI: InChI=1S/C5H12O2/c1-5(4-7)2-3-6/h5-7H,2-4H2,1H3
3. InChIKey: MWCBGWLCXSUTHK-UHFFFAOYSA-N