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CAS No.: | 24583-23-1 |
---|---|
Name: | N-CARBAMOYL-L-CYSTEINE |
Article Data: | 3 |
Molecular Structure: | |
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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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