Boc-N-Me-Ser-OH supplier | CasNO.101772-29-6

Name
BOC-N-ME-SER-OH
EINECS 1533716-785-6
CAS No. 101772-29-6
Density 1.215 g/cm³
Solubility
Melting Point 83-87 °C
Formula C₉H₁₇NO₅
Boiling Point 353.2 °C at 760 mmHg
Molecular Weight 219.238
Flash Point 167.4 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms N-(tert-butoxycarbonyl)-N-methyl-L-serine;Boc-N-Me-Ser-OH;Boc-N-methyl-L-serine;
PSA 87.07000
LogP 0.29880

Boc-N-Me-Ser-OH Specification

The Boc-N-Me-Ser-OH, with the CAS registry number 101772-29-6, has the systematic name of N-(tert-butoxycarbonyl)-N-methyl-L-serine. It belongs to the product category of N-Methyl Amino Acids. And the molecular formula of the chemical is C₉H₁₇NO₅.

The characteristics of Boc-N-Me-Ser-OH are as followings: (1)ACD/LogP: 0.71; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.63; (4)ACD/LogD (pH 7.4): -2.92; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 6; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 65.07 Å²; (13)Index of Refraction: 1.491; (14)Molar Refractivity: 52.26 cm³; (15)Molar Volume: 180.3 cm³; (16)Polarizability: 20.71×10^-24cm³; (17)Surface Tension: 46.7 dyne/cm; (18)Density: 1.215 g/cm³; (19)Flash Point: 167.4 °C; (20)Enthalpy of Vaporization: 69.25 kJ/mol; (21)Boiling Point: 353.2 °C at 760 mmHg; (22)Vapour Pressure: 2.11E-06 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=C(OC(C)(C)C)N(C)[C@H](C(=O)O)CO
(2)InChI: InChI=1/C9H17NO5/c1-9(2,3)15-8(14)10(4)6(5-11)7(12)13/h6,11H,5H2,1-4H3,(H,12,13)/t6-/m0/s1
(3)InChIKey: NJQGIDVCNBZXLG-LURJTMIEBV

Product Name

BOC-N-ME-SER-OH

Boc-N-Me-Ser-OH Specification

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