4-Bromo-2-butanol supplier | CasNO.6089-17-4

Name
4-BROMO-1-BUTANOL
EINECS 251-355-5
CAS No. 6089-17-4
Article Data1
CAS DataBase
Density 1.449 g/cm³
Solubility
Melting Point
Formula C₄H₉BrO
Boiling Point 184.559 °C at 760 mmHg
Molecular Weight 153.019
Flash Point 85.508 °C
Transport Information
Appearance
Safety 26
Risk Codes 11-36/37/38
Molecular Structure
Hazard Symbols F,Xi
Synonyms 1-Bromo-3-butanol;4-Bromobutan-2-ol;
PSA 20.23000
LogP 1.15380

4-Bromo-2-butanol Specification

The 2-Butanol, 4-bromo-, with the CAS registry number 6089-17-4, is also known as 1-Bromo-3-butanol. This chemical's molecular formula is C₄H₉BrO and molecular weight is 153.02. What's more, its systematic name is called 4-Bromo-2-butanol.

Physical properties about 2-Butanol, 4-bromo- are: (1)ACD/LogP: 0.877; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.88; (4)ACD/LogD (pH 7.4): 0.88; (5)ACD/BCF (pH 5.5): 2.73; (6) ACD/BCF (pH 7.4): 2.73; (7)ACD/KOC (pH 5.5): 71.49; (8)ACD/KOC (pH 7.4): 71.49; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 20.23 Å²; (13)Index of Refraction: 1.476; (14)Molar Refractivity: 29.806 cm³; (15)Molar Volume: 105.627 cm³; (16)Polarizability: 11.816×10^-24cm³; (17)Surface Tension: 35.344 dyne/cm; (18)Density: 1.449 g/cm³; (19)Flash Point: 85.508 °C; (20)Enthalpy of Vaporization: 48.978 kJ/mol; (21)Boiling Point: 184.559 °C at 760 mmHg; (22)Vapour Pressure: 0.208 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: CC(O)CCBr
(2) InChI: InChI=1S/C4H9BrO/c1-4(6)2-3-5/h4,6H,2-3H2,1H3
(3) InChIKey: KHZTWUIVCAAVDC-UHFFFAOYSA-N

Product Name

4-BROMO-1-BUTANOL

4-Bromo-2-butanol Specification

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