L-Serine,O-benzoyl- supplier | CasNO.83044-84-2

Name
O-benzoylserine
EINECS
CAS No. 83044-84-2
Density 1.315 g/cm³
Solubility
Melting Point
Formula C₁₀H₁₁NO₄
Boiling Point 398.9 °C at 760 mmHg
Molecular Weight 209.202
Flash Point 195 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms L-Serine,benzoate (ester) (9CI);Serine, benzoate (5CI);L-Serine benzoate;NSC 349124;O-Benzoyl-L-serine;
PSA 89.62000
LogP 0.95560

L-Serine,O-benzoyl- Specification

This chemical is called L-Serine,O-benzoyl-, and its systematic name is O-benzoylserine. With the molecular formula of C₁₀H₁₁NO₄, its molecular weight is 209.20. The CAS registry number of the chemical is 83044-84-2.

Other characteristics of L-Serine,O-benzoyl- can be summarised as followings: (1)ACD/LogP: 1.92; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.57; (4)ACD/LogD (pH 7.4): -0.62; (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: 5; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 55.84 Å²; (13)Index of Refraction: 1.572; (14)Molar Refractivity: 52.35 cm³; (15)Molar Volume: 159 cm³; (16)Polarizability: 20.75×10^-24cm³; (17)Surface Tension: 58.5 dyne/cm; (18)Density: 1.315 g/cm³; (19)Flash Point: 195 °C; (20)Enthalpy of Vaporization: 68.5 kJ/mol; (21)Boiling Point: 398.9 °C at 760 mmHg; (22)Vapour Pressure: 4.44E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: O=C(OCC(C(=O)O)N)c1ccccc1
2.InChI: InChI=1/C10H11NO4/c11-8(9(12)13)6-15-10(14)7-4-2-1-3-5-7/h1-5,8H,6,11H2,(H,12,13)
3.InChIKey: ZQXBXSLGROYFDW-UHFFFAOYAJ
4.Std. InChI: InChI=1S/C10H11NO4/c11-8(9(12)13)6-15-10(14)7-4-2-1-3-5-7/h1-5,8H,6,11H2,(H,12,13)
5.Std. InChIKey: ZQXBXSLGROYFDW-UHFFFAOYSA-N

Product Name

O-benzoylserine

L-Serine,O-benzoyl- Specification

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