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CAS No.: | 3470-53-9 |
---|---|
Name: | 6-Amino-3,4-dihydro-1(2H)-naphthalenone |
Article Data: | 16 |
Molecular Structure: | |
Formula: | C10H11NO |
Molecular Weight: | 161.203 |
Synonyms: | 6-aminotetralin-1-one;6-Amino-1-tetralone;6-amino-3,4-dihydronaphthalen-1(2H)-one;1(2H)-Naphthalenone, 6-amino-3,4-dihydro-; |
Density: | 1.193 g/cm3 |
Melting Point: | 130 °C |
Boiling Point: | 359.36 °C at 760 mmHg |
Flash Point: | 171.135 °C |
Hazard Symbols: | T, Xn, Xi |
Risk Codes: | 20/21/22-25 |
Safety: | 22-26-36/37/39-45 |
Transport Information: | UN 2811 |
PSA: | 43.09000 |
LogP: | 2.36900 |
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The 6-Amino-1,2,3,4-tetrahydronaphthalen-1-one is an organic compound with the formula C10H11NO. The IUPAC name of this chemical is 6-amino-3,4-dihydro-2H-naphthalen-1-one. With the CAS registry number 3470-53-9, it is also named as 1(2H)-Naphthalenone, 6-amino-3,4-dihydro-. The product's categories are Amines; Fused Ring Systems.
Physical properties about 6-Amino-1,2,3,4-tetrahydronaphthalen-1-one are: (1)ACD/LogP: 0.61; (2)ACD/LogD (pH 5.5): 0.61; (3)ACD/LogD (pH 7.4): 0.611; (4)ACD/BCF (pH 5.5): 1.714; (5)ACD/BCF (pH 7.4): 1.714; (6)ACD/KOC (pH 5.5): 51.168; (7)ACD/KOC (pH 7.4): 51.193; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 43.09 Å2; (12)Index of Refraction: 1.62; (13)Molar Refractivity: 47.406 cm3; (14)Molar Volume: 135.04 cm3; (15)Polarizability: 18.793×10-24cm3; (16)Surface Tension: 53.791 dyne/cm; (17)Density: 1.194 g/cm3; (18)Flash Point: 171.135 °C; (19)Enthalpy of Vaporization: 60.495 kJ/mol; (20)Boiling Point: 359.36 °C at 760 mmHg.
When you are using this chemical, please be cautious about it as the following:
It is harmful by inhalation, in contact with skin and if swallowed. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. Besides, this chemical is Toxic if swallowed. When you are using it, wear suitable gloves and eye/face protection and do not breathe dust. In case of accident or if you feel unwell seek medical advice immediately (show the label where possible).
You can still convert the following datas into molecular structure:
(1)SMILES: c1cc2c(cc1N)CCCC2=O
(2)InChI: InChI=1/C10H11NO/c11-8-4-5-9-7(6-8)2-1-3-10(9)12/h4-6H,1-3,11H2
(3)InChIKey: BEVVUJBVEXJGKM-UHFFFAOYAV
(4)Std. InChI: InChI=1S/C10H11NO/c11-8-4-5-9-7(6-8)2-1-3-10(9)12/h4-6H,1-3,11H2
(5)Std. InChIKey: BEVVUJBVEXJGKM-UHFFFAOYSA-N