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212783-75-0

Basic Information
CAS No.: 212783-75-0
Name: FMOC-SUBEROL
Article Data: 2
Molecular Structure:
Molecular Structure of 212783-75-0 (FMOC-SUBEROL)
Formula: C32H27NO5
Molecular Weight: 505.57
Synonyms: Aceticacid, [[5-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-10,11-dihydro-5H-dibenzo[a,d]cyclohepten-2-yl]oxy]-(9CI);[(5-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-10,11-dihydro-5H-dibenzo[a,d][7]annulen-2-yl)oxy]acetic acid;Acetic acid, 2-[[5-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-10,11-dihydro-5H-dibenzo[a,d]cyclohepten-2-yl]oxy]-;Ramage Linker;Ramage Linker Fmoc-Suberol;
EINECS: 606-734-3
Density: 1.365 g/cm3
Boiling Point: 724.118 °C at 760 mmHg
Flash Point: 391.732 °C
Hazard Symbols: Xi
Risk Codes: 36/38
Safety: 26-37/39
PSA: 84.86000
LogP: 6.26760
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Specification

The Acetic acid, 2-[[5-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-10,11-dihydro-5H-dibenzo[a,d]cyclohepten-2-yl]oxy]-, with the CAS registry number 212783-75-0, has the systematic name of [(5-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-10,11-dihydro-5H-dibenzo[a,d][7]annulen-2-yl)oxy]acetic acid. It belongs to the following  product categories: Linkers for Solid Phase Synthesis; Biochemics. And the molecular formula of this chemical is C32H27NO5.

The physical properties of Acetic acid, 2-[[5-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-10,11-dihydro-5H-dibenzo[a,d]cyclohepten-2-yl]oxy]- are as followings: (1)ACD/LogP: 5.42; (2)# of Rule of 5 Violations: 2; (3)ACD/LogD (pH 5.5): 5; (4)ACD/LogD (pH 7.4): 3; (5)ACD/BCF (pH 5.5): 478; (6)ACD/BCF (pH 7.4): 22; (7)ACD/KOC (pH 5.5): 650; (8)ACD/KOC (pH 7.4): 30; (9)#H bond acceptors: 6; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 7; (12)Polar Surface Area: 84.86 Å2; (13)Index of Refraction: 1.697; (14)Molar Refractivity: 142.674 cm3; (15)Molar Volume: 370.501 cm3; (16)Polarizability: 56.56×10-24cm3; (17)Surface Tension: 69.559 dyne/cm; (18)Density: 1.365 g/cm3; (19)Flash Point: 391.732 °C; (20)Enthalpy of Vaporization: 111.013 kJ/mol; (21)Boiling Point: 724.118 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You should be cautious while dealing with this chemical. It irritates eyes and skin. Therefore, you had better take the following instructions: Wear suitable gloves and eye/face protection, and in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)COc1cc3c(cc1)C(c2ccccc2CC3)NC(=O)OCC6c4ccccc4c5ccccc56
(2)InChI: InChI=1/C32H27NO5/c34-30(35)19-37-22-15-16-24-21(17-22)14-13-20-7-1-2-8-23(20)31(24)33-32(36)38-18-29-27-11-5-3-9-25(27)26-10-4-6-12-28(26)29/h1-12,15-17,29,31H,13-14,18-19H2,(H,33,36)(H,34,35)
(3)InChIKey: XHOBPBDZGGKEOX-UHFFFAOYAB