-
Name
(S)-2-PYRIDYLTHIO CYSTEAMINE HYDROCHLORIDE
- EINECS
- CAS No. 83578-21-6
- Article Data23
- CAS DataBase
- Density 1.26 g/cm3
- Solubility
- Melting Point 124-126 °C
- Formula C7H10N2S2
- Boiling Point 305.4 °C at 760 mmHg
- Molecular Weight 186.302
- Flash Point 138.5 °C
- Transport Information
- Appearance off-white solid
- Safety
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms 2-(2-Pyridinyldithio)ethylamine;S-(2-Aminoethyl)dithio-2-pyridine;
- PSA
- LogP
Ethanamine,2-(2-pyridinyldithio)- Specification
The Ethanamine,2-(2-pyridinyldithio)-, with the CAS registry number 83578-21-6, is also known as 2-(2-Pyridinyldithio)ethanamine. It belongs to the product categories of Nitric Oxide Reagents; Cross Linking Reagents; MTS & Sulfhydryl Active Reagents. This chemical's molecular formula is C7H10N2S2 and molecular weight is 186.2977. What's more, its systematic name is called 2-(Pyridin-2-yldisulfanyl)ethanamine. It is off-white solid and can be used as a cleavable cross-linking reagent.
Physical properties about Ethanamine,2-(2-pyridinyldithio)- are: (1) ACD/LogP: 1.59; (2) # of Rule of 5 Violations: 0; (3) ACD/LogD (pH 5.5): -1.1; (4) ACD/LogD (pH 7.4): 0.55; (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): 15.99; (9) #H bond acceptors: 2; (10) #H bond donors: 2; (11) #Freely Rotating Bonds: 5; (12) Polar Surface Area: 66.73 Å2; (13) Index of Refraction: 1.643; (14) Molar Refractivity: 53.46 cm3; (15) Molar Volume: 147.7 cm3; (16) Surface Tension: 61.5 dyne/cm; (17) Density: 1.26 g/cm3; (18) Flash Point: 138.5 °C; (19) Enthalpy of Vaporization: 54.58 kJ/mol; (20) Boiling Point: 305.4 °C at 760 mmHg; (21) Vapour Pressure: 0.000825 mmHg at 25 °C; (22) Melting Point: 124-126 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: S(Sc1ncccc1)CCN
(2) InChI: InChI=1/C7H10N2S2/c8-4-6-10-11-7-3-1-2-5-9-7/h1-3,5H,4,6,8H2
(3) InChIKey: WGGFHAVVTPGHRD-UHFFFAOYAY
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