N-Acetyl 6-Chlorotryptophan supplier

Name
N-Acetyl 6-Chlorotryptophan
EINECS
CAS No. 50517-10-7
Article Data5
CAS DataBase
Density 1.424 g/cm³
Solubility
Melting Point 170-173°C
Formula C₁₃H₁₃ClN₂O₃
Boiling Point 610.6 °C at 760 mmHg
Molecular Weight 280.71
Flash Point 323.1 °C
Transport Information
Appearance White solid
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-(Acetylamino)-3-(6-chloro-1H-indol-3-yl)propanoic acid;
PSA 82.19000
LogP 2.34400

N-Acetyl 6-Chlorotryptophan Specification

The N-Acetyl 6-Chlorotryptophan with CAS registry number of 50517-10-7 is also known as 2-(Acetylamino)-3-(6-chloro-1H-indol-3-yl)propanoic acid. The systematic name is N-Acetyl 6-Chlorotryptophan. It belongs to product categories of Chemical Amines; Amines; Indole Derivatives. In addition, the formula is C₁₃H₁₃ClN₂O₃ and the molecular weight is 280.71. What's more, this chemical is a white solid.

Physical properties about N-Acetyl 6-Chlorotryptophan are: (1)ACD/LogP: 1.30; (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: 5; (7)#H bond donors: 3; (8)#Freely Rotating Bonds: 4; (9)Index of Refraction: 1.651; (10)Molar Refractivity: 72.01 cm³; (11)Molar Volume: 197 cm³; (12)Surface Tension: 62.7 dyne/cm; (13)Density: 1.424 g/cm³; (14)Flash Point: 323.1 °C; (15)Enthalpy of Vaporization: 95.35 kJ/mol; (16)Boiling Point: 610.6 °C at 760 mmHg; (17)Vapour Pressure: 9.13E-16 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
1. SMILES: OC(=O)C(NC(C)=O)Cc2cnc1cc(Cl)ccc12
2. InChI: InChI=1/C13H13ClN2O3/c1-7(17)16-12(13(18)19)4-8-6-15-11-5-9(14)2-3-10(8)11/h2-3,5-6,12,15H,4H2,1H3,(H,16,17)(H,18,19)
3. InChIKey: LCLMWFCLWYOLIO-UHFFFAOYAA
4. Std. InChI: InChI=1S/C13H13ClN2O3/c1-7(17)16-12(13(18)19)4-8-6-15-11-5-9(14)2-3-10(8)11/h2-3,5-6,12,15H,4H2,1H3,(H,16,17)(H,18,19)
5. Std. InChIKey: LCLMWFCLWYOLIO-UHFFFAOYSA-N

Product Name

N-Acetyl 6-Chlorotryptophan

N-Acetyl 6-Chlorotryptophan Specification

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