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CAS No.: | 105496-31-9 |
---|---|
Name: | N-FMOC-ETHANOLAMINE |
Article Data: | 36 |
Molecular Structure: | |
Formula: | C17H17NO3 |
Molecular Weight: | 283.327 |
Synonyms: | Carbamicacid, (2-hydroxyethyl)-, 9H-fluoren-9-ylmethyl ester (9CI);Fmoc-glycinol;N-(9-Fluorenylmethoxycarbonyl)-2-aminoethanol;N-Fmoc-2-aminoethanol;Fmoc-Gly-ol; |
EINECS: | 626-390-8 |
Density: | 1.238 g/cm3 |
Melting Point: | 144-147 °C(lit.) |
Boiling Point: | 502.7 °C at 760 mmHg |
Flash Point: | 257.8 °C |
Hazard Symbols: | Xi |
Risk Codes: | 36/37/38 |
Safety: | 26-36 |
PSA: | 58.56000 |
LogP: | 2.90830 |
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The Carbamic acid,N-(2-hydroxyethyl)-, 9H-fluoren-9-ylmethyl ester with the CAS number 105496-31-9 is also called N-(9-Fluorenylmethoxycarbonyl)-2-aminoethanol. The systematic name is 9H-fluoren-9-ylmethyl (2-hydroxyethyl)carbamate. Its molecular formula is C17H17NO3. This chemical belongs to the following product categories: (1)Amino Acids; (2)Amino Alcohol; (3)Fmoc-Amino acid series. It should be stored at 2-8°C.
The properties of the Carbamic acid,N-(2-hydroxyethyl)-, 9H-fluoren-9-ylmethyl ester are: (1)ACD/LogP: 2.93; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.93; (4)ACD/LogD (pH 7.4): 2.93; (5)ACD/BCF (pH 5.5): 99.38; (6)ACD/BCF (pH 7.4): 99.37; (7)ACD/KOC (pH 5.5): 936.01; (8)ACD/KOC (pH 7.4): 935.91; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 38.77Å2; (13)Index of Refraction: 1.609; (14)Molar Refractivity: 79.29 cm3; (15)Molar Volume: 228.7 cm3; (16)Polarizability: 31.43×10-24cm3; (17)Surface Tension: 53.9 dyne/cm; (18)Enthalpy of Vaporization: 81.27 kJ/mol; (19)Vapour Pressure: 6.34×10-11 mmHg at 25°C.
While using this chemical, you should be very cautious. This chemical is not only irritating to skin, but also irritating to eyes and respiratory system. Therefore, you should take the following instructions. Firstly, you should wear suitable protective clothing. Then in case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCC3c1ccccc1c2c3cccc2)NCCO
(2)InChI: InChI=1/C17H17NO3/c19-10-9-18-17(20)21-11-16-14-7-3-1-5-12(14)13-6-2-4-8-15(13)16/h1-8,16,19H,9-11H2,(H,18,20)
(3)InChIKey: XLIFWDZVNRWYKV-UHFFFAOYAG