6-Chloro-4-(trifluoromethyl)nicotinonitrile

Modify Date: 2025-09-09 19:34:46

6-Chloro-4-(trifluoromethyl)nicotinonitrile Structure
6-Chloro-4-(trifluoromethyl)nicotinonitrile structure
Common Name 6-Chloro-4-(trifluoromethyl)nicotinonitrile
CAS Number 1201187-18-9 Molecular Weight 206.552
Density 1.5±0.1 g/cm3 Boiling Point 252.0±35.0 °C at 760 mmHg
Molecular Formula C7H2ClF3N2 Melting Point N/A
MSDS N/A Flash Point 106.2±25.9 °C

 Names

Name 6-Chloro-4-(trifluoromethyl)nicotinonitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.5±0.1 g/cm3
Boiling Point 252.0±35.0 °C at 760 mmHg
Molecular Formula C7H2ClF3N2
Molecular Weight 206.552
Flash Point 106.2±25.9 °C
Exact Mass 205.985855
PSA 36.68000
LogP 2.29
Vapour Pressure 0.0±0.5 mmHg at 25°C
Index of Refraction 1.483
InChIKey MXQLUANSPBCUGU-UHFFFAOYSA-N
SMILES N#Cc1cnc(Cl)cc1C(F)(F)F
Storage condition 2-8°C

 Safety Information

Hazard Codes Xi

 Synthetic Route

~0%

6-Chloro-4-(trifluoromethyl)nicotinonitrile Structure

6-Chloro-4-(tri...

CAS#:1201187-18-9

Literature: ASTRAZENECA AB Patent: WO2006/68618 A1, 2006 ; Location in patent: Page/Page column 36-37 ; WO 2006/068618 A1

 Synonyms

4-chloro-2-methylthio-6-pyrrolidinylpyrimidine-5-carbaldehyde
6-chloro-4-(S)-cyclopropylethynyl-4(S)-trifluoro-methyl-1,4-dihydro-2H-3,1-benzoxazin-2-one
4-Chloro-2-methylsulfanyl-6-pyrrolidin-1-yl-pyrimidine-5-carbaldehyde
6-chloro-4-(pyrrolidin-1-yl)-2-methylthiopyrimidine-5-carbaldehyde
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