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7217-84-7

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Basic Information
CAS No.: 7217-84-7
Name: L-Cysteine, N-benzoyl-
Article Data: 10
Molecular Structure:
Molecular Structure of 7217-84-7 (L-Cysteine, N-benzoyl-)
Formula: C10H11NO3S
Molecular Weight: 225.268
Synonyms: N-(phenylcarbonyl)-L-cysteine;
Density: 1.31 g/cm3
Boiling Point: 486.7 °C at 760 mmHg
Flash Point: 248.1 °C
PSA: 105.20000
LogP: 1.19030
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Specification

The L-Cysteine, N-benzoyl- is an organic compound with the formula C10H11NO3S. With the CAS registry number 7217-84-7, its IUPAC name is N-(phenylcarbonyl)-L-cysteine.

Physical properties of L-Cysteine, N-benzoyl-: (1)ACD/LogP: 1.57; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 4; (7)#H bond donors: 2; (8)#Freely Rotating Bonds: 5; (9)Index of Refraction: 1.597; (10)Molar Refractivity: 58.56 cm3; (11)Molar Volume: 171.8 cm3; (12)Surface Tension: 56.4 dyne/cm; (13)Density: 1.31 g/cm3; (14)Flash Point: 248.1 °C; (15)Enthalpy of Vaporization: 79.25 kJ/mol; (16)Boiling Point: 486.7 °C at 760 mmHg; (17)Vapour Pressure: 2.76E-10 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(N[C@@H](CS)C(O)=O)c1ccccc1
(2)InChI: InChI=1/C10H11NO3S/c12-9(7-4-2-1-3-5-7)11-8(6-15)10(13)14/h1-5,8,15H,6H2,(H,11,12)(H,13,14)/t8-/m0/s1
(3)InChIKey: LJWSDBHOEIBWJY-QMMMGPOBBZ