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4552-50-5

Basic Information
CAS No.: 4552-50-5
Name: (7,7-DIMETHYL-2-OXO-BICYCLO[2.2.1]HEPT-1-YL)-METHANESULFONYL CHLORIDE
Article Data: 4
Molecular Structure:
Molecular Structure of 4552-50-5 ((7,7-DIMETHYL-2-OXO-BICYCLO[2.2.1]HEPT-1-YL)-METHANESULFONYL CHLORIDE)
Formula: C10H15ClO3S
Molecular Weight: 250.746
Synonyms: 10-Bornanesulfonylchloride, 2-oxo- (7CI,8CI);
Density: 1.331 g/cm3
Melting Point: 66-68 °C(lit.)
Boiling Point: 349.4 °C at 760 mmHg
Flash Point: 165.1 °C
Solubility: Decomposes
Hazard Symbols: CorrosiveC
Risk Codes: 34
Safety: 26-27-28-36/37/39-45
Transport Information: UN 3261 8/PG 2
PSA: 59.59000
LogP: 3.03120
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Specification

This chemical is called Bicyclo[2.2.1]heptane-1-methanesulfonylchloride, 7,7-dimethyl-2-oxo-, and its systematic name is (7,7-dimethyl-2-oxobicyclo[2.2.1]hept-1-yl)methanesulfonyl chloride. With the molecular formula of C10H15ClO3S, its molecular weight is 250.74. The CAS registry number of this chemical is 4552-50-5. Additionally, it should be sealed in the cool and dry plcace, away from oxides.

Other characteristics of the Bicyclo[2.2.1]heptane-1-methanesulfonylchloride, 7,7-dimethyl-2-oxo- can be summarised as followings: (1)ACD/LogP: 1.55; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 59.59 Å2; (7)Index of Refraction: 1.528; (8)Molar Refractivity: 58.02 cm3; (9)Molar Volume: 188.3 cm3; (10)Polarizability: 23×10-24cm3; (11)Surface Tension: 44.2 dyne/cm; (12)Density: 1.331 g/cm3; (13)Flash Point: 165.1 °C; (14)Enthalpy of Vaporization: 59.39 kJ/mol; (15)Boiling Point: 349.4 °C at 760 mmHg; (16)Vapour Pressure: 4.71E-05 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following: This chemical causes burns. Wear suitable protective clothing, gloves and eye/face protection if you use it. After contact with skin, wash immediately with plenty of soap-suds and take off immediately all contaminated clothing. In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.).

You can still convert the following datas into molecular structure:
1.SMILES: ClS(=O)(=O)CC12C(=O)CC(CC1)C2(C)C
2.InChI: InChI=1/C10H15ClO3S/c1-9(2)7-3-4-10(9,8(12)5-7)6-15(11,13)14/h7H,3-6H2,1-2H3
3.InChIKey: BGABKEVTHIJBIW-UHFFFAOYAQ