-
Name
8-CHLORO-[1,2,4]TRIAZOLO[4,3-A]PYRAZINE
- EINECS
- CAS No. 68774-77-6
- Article Data12
- CAS DataBase
- Density 1.716 g/cm3
- Solubility
- Melting Point 215-220℃
- Formula C5H3ClN4
- Boiling Point
- Molecular Weight 154.559
- Flash Point
- Transport Information
- Appearance
- Safety 26
- Risk Codes 22-36/37/38
-
Molecular Structure
- Hazard Symbols Xn
- Synonyms 8-Chloro-[1,2,4]triazolo[4,3-a]pyrazine;8-Chlorotriazolo[4,3-a]pyrazine;
- PSA 43.08000
- LogP 0.77770
8-Chlorotriazolo[4,3-a]pyrazine Specification
The 8-Chlorotriazolo[4,3-a]pyrazine with the cas number 68774-77-6 is also called 1,2,4-Triazolo[4,3-a]pyrazine,8-chloro-. The systematic name is 8-chloro[1,2,4]triazolo[4,3-a]pyrazine. Its molecular formula is C5H3ClN4. This chemical should be stored in dry and cool environment.
The properties of the chemical are: (1)ACD/LogP: 0.26; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0; (4)ACD/LogD (pH 7.4): 0; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 33; (8)ACD/KOC (pH 7.4): 33; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 43.08 Å2; (13)Index of Refraction: 1.792; (14)Molar Refractivity: 38.204 cm3; (15)Molar Volume: 90.069 cm3; (16)Polarizability: 15.145×10-24cm3; (17)Surface Tension: 69.494 dyne/cm.
You can still convert the following datas into molecular structure:
(1)SMILES: c1cn2cnnc2c(n1)Cl
(2)InChI: InChI=1/C5H3ClN4/c6-4-5-9-8-3-10(5)2-1-7-4/h1-3H
(3)InChIKey: VKZJRJVVFDDJKP-UHFFFAOYAV
About|Contact|Cas|Product Name|Molecular|Country|Encyclopedia
Message|New Cas|MSDS|Service|Advertisement|CAS DataBase|Article Data|Manufacturers | Chemical Catalog
©2008 LookChem.com,License: ICP
NO.:Zhejiang16009103
complaints:service@lookchem.com Desktop View