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53402-10-1

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Basic Information
CAS No.: 53402-10-1
Name: (1R)-(-)-Thiocamphor
Article Data: 34
Molecular Structure:
Molecular Structure of 53402-10-1 ((1R)-(-)-Thiocamphor)
Formula: C10H16S
Molecular Weight: 168.303
Synonyms: (1R,4R)-1,7,7-Trimethylbicyclo[2.2.1]heptane-2-thione;(R)-Retro-thiorphan;
Density: 1.03 g/cm3
Melting Point: 136-138 °C
Boiling Point: 229 °C at 760 mmHg
Flash Point: 81.7 °C
Hazard Symbols: FlammableF,IrritantXi
Risk Codes: 11-36/37/38
Safety: 16-26-36
Transport Information: UN 1325
PSA: 32.09000
LogP: 3.20250
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Specification

The (1R)-(-)-Thiocamphor, with the CAS registry number 53402-10-1, is also known as (R)-Retro-thiorphan. It belongs to the product categories of Bicyclic Monoterpenes; Biochemistry; Terpenes. This chemical's molecular formula is C10H16S and molecular weight is 168.3. What's more, its systematic name is (1R,4R)-1,7,7-trimethylbicyclo[2.2.1]heptane-2-thione. It should be sealed and stored in a cool, ventilated and dry place. What's more, it should be ensured that the workshop is well ventilated or equipped with exhaust devices.

Physical properties of (1R)-(-)-Thiocamphor are: (1)ACD/LogP: 2.29; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.29; (4)ACD/BCF (pH 5.5): 32.13; (5)ACD/KOC (pH 5.5): 417.11; (6)#Freely Rotating Bonds: 0; (7)Polar Surface Area: 32.09 Å2; (8)Index of Refraction: 1.542; (9)Molar Refractivity: 51.36 cm3; (10)Molar Volume: 163 cm3; (11)Polarizability: 20.36×10-24cm3; (12)Surface Tension: 39.4 dyne/cm; (13)Density: 1.03 g/cm3; (14)Flash Point: 81.7 °C; (15)Enthalpy of Vaporization: 44.67 kJ/mol; (16)Boiling Point: 229 °C at 760 mmHg; (17)Vapour Pressure: 0.107 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
It is highly flammable, so you should keep it away from sources of ignition - No smoking. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing.

You can still convert the following datas into molecular structure:
(1)SMILES: S=C1C[C@H]2CC[C@]1(C)C2(C)C
(2)InChI: InChI=1S/C10H16S/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7H,4-6H2,1-3H3/t7-,10+/m1/s1
(3)InChIKey: AAADKYXUTOBAGS-XCBNKYQSSA-N