Benzyl (2S,3R)-(+)-6-oxo-2,3-diphenyl-4-morpholinecarboxylate supplier

Name
Benzyl (2S,3R)-(+)-6-oxo-2,3-diphenyl-4-morpholinecarboxylate
EINECS
CAS No. 105228-46-4
Article Data4
CAS DataBase
Density 1.242 g/cm³
Solubility
Melting Point 205-207 °C(lit.)
Formula C₂₄H₂₁NO₄
Boiling Point 583.5 °C at 760 mmHg
Molecular Weight 387.435
Flash Point 306.7 °C
Transport Information
Appearance
Safety 26-37/39
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms 4-Morpholinecarboxylicacid, 6-oxo-2,3-diphenyl-, phenylmethyl ester, (2S-cis)-;benzyl (2S,3R)-6-oxo-2,3-diphenylmorpholine-4-carboxylate;4-morpholinecarboxylic acid, 6-oxo-2,3-diphenyl-, phenylmethyl ester, (2S,3R)-;Benzyl (2S,3R)-6-oxo-2,3-diphenyl-4-morpholinecarboxylate;Benzyl (2S,3R)-6-oxo-2,3-diphenylmorpholine-4-carboxylate;
PSA 55.84000
LogP 4.60250

Benzyl (2S,3R)-(+)-6-oxo-2,3-diphenyl-4-morpholinecarboxylate Specification

The Benzyl (2S,3R)-(+)-6-oxo-2,3-diphenyl-4-morpholinecarboxylate, with the CAS registry number 105228-46-4, has the systematic name of benzyl (2S,3R)-6-oxo-2,3-diphenylmorpholine-4-carboxylate. It belongs to the following product categories: Chiral Building Blocks; Heterocyclic Building Blocks; Morpholines. And the molecular formula of the chemical is C₂₄H₂₁NO₄.

The characteristics of Benzyl (2S,3R)-(+)-6-oxo-2,3-diphenyl-4-morpholinecarboxylate are as followings: (1)ACD/LogP: 4.06; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 5; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 5; (6)Polar Surface Area: 55.84 Å²; (7)Index of Refraction: 1.609; (8)Molar Refractivity: 108.07 cm³; (9)Molar Volume: 311.7 cm³; (10)Polarizability: 42.84×10^-24cm³; (11)Surface Tension: 51.5 dyne/cm; (12)Density: 1.242 g/cm³; (13)Flash Point: 306.7 °C; (14)Enthalpy of Vaporization: 87.21 kJ/mol; (15)Boiling Point: 583.5 °C at 760 mmHg; (16)Vapour Pressure: 1.33E-13 mmHg at 25°C.

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

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=C(OCc1ccccc1)N3[C@H](c2ccccc2)[C@@H](OC(=O)C3)c4ccccc4
(2)InChI: InChI=1/C24H21NO4/c26-21-16-25(24(27)28-17-18-10-4-1-5-11-18)22(19-12-6-2-7-13-19)23(29-21)20-14-8-3-9-15-20/h1-15,22-23H,16-17H2/t22-,23+/m1/s1
(3)InChIKey: HECRUWTZAMPQOS-PKTZIBPZBT

Product Name

Benzyl (2S,3R)-(+)-6-oxo-2,3-diphenyl-4-morpholinecarboxylate

Benzyl (2S,3R)-(+)-6-oxo-2,3-diphenyl-4-morpholinecarboxylate Specification

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