6-(1H-pyrazol-1-yl)pyridine-2-carbonitrile

HCID 22939554
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Basic information

CAS
501378-98-9
Standard SMILES
N#Cc1cccc(-n2cccn2)n1
InChIKey
BLXJHROZIGSIQS-UHFFFAOYSA-N
Molecular formula
C9H6N4
Average molar mass
170.17 g/mol
Monoisotopic mass
170.05924621

Names & identifiers

Preferred name
6-(1H-pyrazol-1-yl)pyridine-2-carbonitrile
IUPAC
6-pyrazol-1-ylpyridine-2-carbonitrile
English name
6-(1H-pyrazol-1-yl)pyridine-2-carbonitrile
Molecular formula
C9H6N4
Molecular weight
170.17

Names & synonyms

6-(1H-pyrazol-1-yl)pyridine-2-carbonitrile501378-98-96-(1h-Pyrazol-1-yl)picolinonitrile6-pyrazol-1-ylpyridine-2-carbonitrileSCHEMBL2952613BLXJHROZIGSIQS-UHFFFAOYSA-NBVA37898AKOS013757858NCGC00664329-016-(Pyrazol-1-yl)-2-pyridinecarbonitrileDB-1400526-(1H-pyrazol-1-yl)-2-pyridinecarbonitrile
Show more names
2-Pyridinecarbonitrile, 6-(1H-pyrazol-1-yl)-
CS-0305576EN300-81597G26010F8881-0310Z1227765672

Database identifiers

CAS
501378-98-9
PubChem CID
22939554
EC Number
191-444-5

Properties

Computed structural properties

XLogP
1.2
Topological polar surface area
54.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
13

Physicochemical properties

Boiling point
348 · 348.0±27.0 °C(Predicted)
Density
1.23 · 1.23±0.1 g/cm3(Predicted)
pka
-1.94 · -1.94±0.19(Predicted)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335

Safety & regulation

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

Chemistry & industry

Suppliers2 total

陕西爱施达尔生物科技有限公司18682931470; 18682931470 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]

Related reactions

5 records
New reaction record

Compound notes

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