1-bromo-3-phenylpropane

1-bromo-3-phenylpropane structural formula

Structural formula

Business number 070V
Molecular formula C9H11Br
Molecular weight 199.09
label

(3-bromopropyl)benzene,

3-phenylpropyl bromide,

3-Phenylpropyl bromide,

(3-Bromopropyl)benzene,

3-Phenylpropyl bromide,

Hydrocinnamyl bromide,

C6H5(CH2)3Br

Numbering system

CAS number:637-59-2

MDL number:MFCD00000257

EINECS number:211-294-7

RTECS number:None

BRN number:2205527

PubChem number:24887402

Physical property data


1. Characteristics: colorless liquid.


2. Density (g/mL,25/4 ℃):1.310


3. Relative vapor density (g/mL,air=1): Undetermined


4. Melting point (ºC ): Undetermined


5. Boiling point (ºC,Normal pressure):220


6. Boiling point (ºC,5.2kPa): Undetermined


7. Refractive index:1.5450


8. Flash point (ºC): 101


9. Specific rotation (º): Undetermined


10. Autoignition point or ignition temperature (ºC): Undetermined


11. Vapor pressure (kPa,25ºC): Undetermined


12. Saturated vapor pressure (kPa, 60ºC): Undetermined


13. Heat of combustion (KJ/mol): Undetermined


14. Critical temperature (ºC): Undetermined


15. Critical pressure (KPa): Undetermined


16. Oil and water (octanol/Log value of the partition coefficient (water): undetermined


17. Explosion upper limit (%,V/V): Undetermined


18. Lower explosion limit (%,V/V): Undetermined


19. Solubility: Not determined.


Toxicological data

None yet

Ecological data

Usually not harmful to water, Do not discharge materials into the surrounding environment without government permission.

Molecular structure data

1. Molar refractive index: 48.16


2. Molar Volume (m3/mol):151.9


3. isotonic ratio (90.2K):375.7


4. Surface Tension (dyne/cm):37.4


5. Polarizability10-24cm3):19.09



Compute chemical data

1. Reference value for hydrophobic parameter calculation (XlogP): None

2. Number of hydrogen bond donors: 0

3. Number of hydrogen bond acceptors: 0

4. Number of rotatable chemical bonds: 3

5. Number of tautomers: none

6. Topological molecule polar surface area 0

7. Number of heavy atoms: 10

8. Surface charge: 0

9. Complexity: 74.8

10. Number of isotope atoms: 0

11. Determine the number of atomic stereocenters: 0

12. Uncertain number of atomic stereocenters: 0

13. Determine the number of chemical bond stereocenters: 0

14. Number of uncertain chemical bond stereocenters: 0

15. Number of covalent bond units: 1

Properties and stability

Keep away from oxides.

Storage method

This product should be kept sealed.

Synthesis method

None yet

Purpose

For organic synthesis.

Resource:allhdi.com

This article is from the Internet, does not represent the position of Toluene diisocyanate reproduced please specify the source.https://www.allhdi.com/archives/49142

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