1-Bromo-2-(methylsulfonyl)benzene supplier

Name
1-Bromo-2-(methylsulfonyl)benzene
EINECS
CAS No. 33951-33-6
Article Data27
CAS DataBase
Density 1.595 g/cm³
Solubility
Melting Point 106-110 °C
Formula C₇H₇BrO₂S
Boiling Point 361.6 °C at 760 mmHg
Molecular Weight 235.101
Flash Point 172.5 °C
Transport Information
Appearance
Safety 26
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms Sulfone,o-bromophenyl methyl (6CI,8CI);1-Bromo-2-(methylsulfonyl)benzene;2-Bromophenyl methyl sulfone;o-Bromo(methylsulfonyl)benzene;o-Bromophenylmethyl sulfone;
PSA 42.52000
LogP 2.93340

1-Bromo-2-(methylsulfonyl)benzene Specification

This chemical is called Benzene, 1-bromo-2-(methylsulfonyl)-, and its systematic name is 1-bromo-2-(methylsulfonyl)benzene. With the molecular formula of C₇H₇BrO₂S, its molecular weight is 235.11. The CAS registry number of this chemical is 33951-33-6. Additionally, its product category is Thioderivates.

Other characteristics of the Benzene, 1-bromo-2-(methylsulfonyl)- can be summarised as followings: (1)ACD/LogP: 1.03; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.03; (4)ACD/LogD (pH 7.4): 1.03; (5)ACD/BCF (pH 5.5): 3.58; (6)ACD/BCF (pH 7.4): 3.58; (7)ACD/KOC (pH 5.5): 86.64; (8)ACD/KOC (pH 7.4): 86.64; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 42.52 Å²; (13)Index of Refraction: 1.563; (14)Molar Refractivity: 47.91 cm³; (15)Molar Volume: 147.3 cm³; (16)Polarizability: 18.99×10^-24cm³; (17)Surface Tension: 41.6 dyne/cm; (18)Density: 1.595 g/cm³; (19)Flash Point: 172.5 °C; (20)Enthalpy of Vaporization: 58.35 kJ/mol; (21)Boiling Point: 361.6 °C at 760 mmHg; (22)Vapour Pressure: 4.26E-05 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing if you use it. 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: O=S(=O)(c1ccccc1Br)C
2.InChI: InChI=1/C7H7BrO2S/c1-11(9,10)7-5-3-2-4-6(7)8/h2-5H,1H3
3.InChIKey: KEBPSJRKAZKUKP-UHFFFAOYAL

Product Name

1-Bromo-2-(methylsulfonyl)benzene

1-Bromo-2-(methylsulfonyl)benzene Specification

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