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24583-23-1

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Basic Information
CAS No.: 24583-23-1
Name: N-CARBAMOYL-L-CYSTEINE
Article Data: 3
Molecular Structure:
Molecular Structure of 24583-23-1 (N-CARBAMOYL-L-CYSTEINE)
Formula: C4H8N2O3S
Molecular Weight: 164.185
Synonyms: Cysteine,N-carbamoyl-, L- (8CI);L-Cysteine-N-carbamide;N-(Aminocarbonyl)cysteine;N-Carbamoyl-L-cysteine;
EINECS: 246-329-5
Density: 1.45 g/cm3
Melting Point: >160°C (dec.)
Boiling Point: 347.7 °C at 760 mmHg
Flash Point: 164.1 °C
Hazard Symbols: Xi
Risk Codes: 36
Safety: 26
PSA: 131.22000
LogP: 0.12890
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    MF: C4H8N2O3S MW: 164.18 EINECS: 246-329-5 Product Categories: GLYCINESCAFFOLD;Amino Acids & Derivatives;Sulfur & Selenium Compounds

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Specification

The L-Cysteine,N-(aminocarbonyl)-, with the CAS registry number 24583-23-1, is also known as N-(Aminocarbonyl)cysteine. It belongs to the product categories of Glycinescaffold; Amino Acids & Derivatives; Sulfur & Selenium Compounds. Its EINECS number is 246-329-5. This chemical's molecular formula is C4H8N2O3S and molecular weight is 164.18. What's more, its systematic name is N-carbamoyl-L-cysteine. 

Physical properties of L-Cysteine,N-(aminocarbonyl)- are: (1)ACD/LogP: -0.33; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.95; (4)ACD/LogD (pH 7.4): -4.02; (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: 4; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 75.15 Å2; (13)Index of Refraction: 1.57; (14)Molar Refractivity: 37.15 cm3; (15)Molar Volume: 113.2 cm3; (16)Polarizability: 14.73×10-24cm3; (17)Surface Tension: 67.3 dyne/cm; (18)Density: 1.45 g/cm3; (19)Flash Point: 164.1 °C; (20)Enthalpy of Vaporization: 65.05 kJ/mol; (21)Boiling Point: 347.7 °C at 760 mmHg; (22)Vapour Pressure: 9.23E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)[C@@H](NC(=O)N)CS
(2)InChI: InChI=1S/C4H8N2O3S/c5-4(9)6-2(1-10)3(7)8/h2,10H,1H2,(H,7,8)(H3,5,6,9)/t2-/m0/s1
(3)InChIKey: APFSAMXTZRYBKF-REOHCLBHSA-N