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CAS No.: | 177017-68-4 |
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Name: | (R)-(+)-6-METHOXY 2-AMINOTETRALIN |
Molecular Structure: | |
Formula: | C11H15NO |
Molecular Weight: | 177.246 |
Synonyms: | 2-Naphthalenamine,1,2,3,4-tetrahydro-6-methoxy-, (R)-; |
Density: | 1.056 g/cm3 |
Boiling Point: | 299.6 °C at 760 mmHg |
Flash Point: | 139.7 °C |
PSA: | 35.25000 |
LogP: | 2.21150 |
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This chemical is called 2-Naphthalenamine,1,2,3,4-tetrahydro-6-methoxy-, (2R)-, and its systematic name is (2R)-6-Methoxy-1,2,3,4-tetrahydronaphthalen-2-amine. With the molecular formula of C11H15NO, its molecular weight is 177.24. The CAS registry number of this chemical is 177017-68-4.
Other characteristics of 2-Naphthalenamine,1,2,3,4-tetrahydro-6-methoxy-, (2R)- can be summarised as followings: (1)ACD/LogP: 2.01; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 2; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 35.25 Å2; (11)Index of Refraction: 1.547; (12)Molar Refractivity: 53.27 cm3; (13)Molar Volume: 167.8 cm3; (14)Polarizability: 21.11×10-24cm3; (15)Surface Tension: 39.2 dyne/cm; (16)Density: 1.056 g/cm3; (17)Flash Point: 139.7 °C; (18)Enthalpy of Vaporization: 53.96 kJ/mol; (19)Boiling Point: 299.6 °C at 760 mmHg; (20)Vapour Pressure: 0.00118 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: COc1ccc2C[C@H](N)CCc2c1
2.InChI: InChI=1/C11H15NO/c1-13-11-5-3-8-6-10(12)4-2-9(8)7-11/h3,5,7,10H,2,4,6,12H2,1H3/t10-/m1/s1
3.InChIKey: WASIYUSITZITPW-SNVBAGLBBF
4.Std. InChI: InChI=1S/C11H15NO/c1-13-11-5-3-8-6-10(12)4-2-9(8)7-11/h3,5,7,10H,2,4,6,12H2,1H3/t10-/m1/s1
5.Std. InChIKey: WASIYUSITZITPW-SNVBAGLBSA-N