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Basic Information
CAS No.: 111525-02-1
Name: N-(1-NAPHTHALEN-2-YL-ETHYL)-HYDROXYLAMINE
Article Data: 2
Molecular Structure:
Molecular Structure of 111525-02-1 (N-(1-NAPHTHALEN-2-YL-ETHYL)-HYDROXYLAMINE)
Formula: C12H13NO
Molecular Weight: 187.241
Synonyms: N-(1-NAPHTHALEN-2-YL-ETHYL)-HYDROXYLAMINE
Density: 1.145 g/cm3
Boiling Point: 363.362 °C at 760 mmHg
Flash Point: 160.758 °C
PSA: 32.26000
LogP: 3.27050
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Specification

The 2-Naphthalenemethanamine,N-hydroxy-a-methyl-, with the CAS registry number of 111525-02-1, is also known as N-Hydroxy-1-(2-naphthyl)ethanamine. Its molecular formula is C12H13NO and molecular weight is 187.24. What's more, its systematic name is N-[1-(2-Naphthyl)ethyl]hydroxylamine.

Physical properties about the 2-Naphthalenemethanamine,N-hydroxy-a-methyl- are: (1)ACD/LogP: 2.78; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3; (4)ACD/LogD (pH 7.4): 3; (5)ACD/BCF (pH 5.5): 56; (6)ACD/BCF (pH 7.4): 90; (7)ACD/KOC (pH 5.5): 545; (8)ACD/KOC (pH 7.4): 872; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 32.26 Å2; (13)Index of Refraction: 1.639; (14)Molar Refractivity: 58.777 cm3; (15)Molar Volume: 163.437 cm3; (16)Surface Tension: 48.387 dyne/cm; (17)Density: 1.146 g/cm3; (18)Flash Point: 160.758 °C; (19)Enthalpy of Vaporization: 64.299 kJ/mol; (20)Boiling Point: 363.362 °C at 760 mmHg; (21)Vapour Pressure: 0 mmHg at 25 °C.

Uses: it is used to produce other chemicals. For example, it is used to produce 3-[Hydroxy-(1-naphthalen-2-yl-ethyl)-amino]-1-naphthalen-2-yl-propenone. This reaction needs reagent p-TsOH. Meanwhile, it needs solvent Methanol. The reaction time is 30 min with reaction temperature of 20 °C. The yield is about 61 %.

The 2-Naphthalenemethanamine,N-hydroxy-a-methyl- can react with 1-Naftyl-3-dimethylamino-2-propen-1-one to get 3-[Hydroxy-(1-naphthalen-2-yl-ethyl)-amino]-1-naphthalen-2-yl-propenone

You can still convert the following datas into molecular structure:
(1) SMILES: CC(c1ccc2ccccc2c1)NO
(2) InChI: InChI=1/C12H13NO/c1-9(13-14)11-7-6-10-4-2-3-5-12(10)8-11/h2-9,13-14H,1H3
(3) InChIKey: FXXGFKZGWPEIDO-UHFFFAOYAY