| Identification | More | [Name]
3-Isoquinolinecarbonitrile | [CAS]
26947-41-1 | [Synonyms]
3-ISOQUINOLINECARBONITRILE
ISOQUINOLINE-3-CARBONITRILE
3-Cyanoisoquinoline
Isoquinoline-3-carbonitrile,99% | [EINECS(EC#)]
620-659-3 | [Molecular Formula]
C10H6N2 | [MDL Number]
MFCD00075136 | [Molecular Weight]
154.17 | [MOL File]
26947-41-1.mol |
| Chemical Properties | Back Directory | [Melting point ]
126-128 °C (lit.) | [Boiling point ]
348.9±15.0 °C(Predicted) | [density ]
1.21±0.1 g/cm3(Predicted) | [storage temp. ]
Sealed in dry,Room Temperature | [form ]
Crystalline Powder | [pka]
0.57±0.30(Predicted) | [color ]
White to yellow | [Water Solubility ]
Insoluble in water. | [BRN ]
114887 | [InChI]
1S/C10H6N2/c11-6-10-5-8-3-1-2-4-9(8)7-12-10/h1-5,7H | [InChIKey]
GXXBVBVNGMCFIU-UHFFFAOYSA-N | [SMILES]
N#Cc1cc2ccccc2cn1 | [CAS DataBase Reference]
26947-41-1(CAS DataBase Reference) |
| Safety Data | Back Directory | [Hazard Codes ]
Xn | [Risk Statements ]
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
R36/37/38:Irritating to eyes, respiratory system and skin . | [Safety Statements ]
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S37/39:Wear suitable gloves and eye/face protection . | [RIDADR ]
3439 | [WGK Germany ]
3
| [HazardClass ]
6.1 | [PackingGroup ]
III | [HS Code ]
29334900 | [Storage Class]
11 - Combustible Solids | [Hazard Classifications]
Acute Tox. 4 Dermal
Acute Tox. 4 Inhalation
Acute Tox. 4 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3 |
| Hazard Information | Back Directory | [Chemical Properties]
White solid | [Uses]
3-Isoquinolinecarbonitrile was employed as analytical standard to study the thermal degradation of 2-chlorobenzylidenemalononitrile (CS riot control agent) at elevated temperatures. | [Definition]
ChEBI: 3-Isoquinolinecarbonitrile is a member of isoquinolines. | [Synthesis Reference(s)]
Canadian Journal of Chemistry, 32, p. 641, 1954 DOI: 10.1139/v54-084 |
|
| Company Name: |
J & K SCIENTIFIC LTD.
|
| Telephone: |
18210857532 18210857532 |
| Website: |
https://www.jkchemical.com |
| Company Name: |
Alfa Aesar
|
| Telephone: |
400-6106006 |
| Website: |
http://chemicals.thermofisher.cn |
| Company Name: |
Energy Chemical
|
| Telephone: |
400-0056266 |
| Website: |
www.energy-chemical.com |
| Company Name: |
Shanghai Ennopharm Co., Ltd.
|
| Telephone: |
+86 (21) 6435-5022 |
| Website: |
www.chemicalbook.com/ShowSupplierProductsList13640/0_EN.htm |
| Company Name: |
China Langchem Inc.
|
| Telephone: |
0086-21-58956006 |
| Website: |
www.chemicalbook.com/ShowSupplierProductsList19141/0_EN.htm |
| Company Name: |
Modachem Shanghai Co., Ltd
|
| Telephone: |
+86 (0)21 51320687 51371369 1744605818 |
| Website: |
www.chemicalbook.com/ShowSupplierProductsList16334/0_EN.htm |
|