CAS 1620-75-3 6-Methylpyridine-2-carbonitrile (HCID 74182)

Names & identifiers

Preferred name: 6-Methylpyridine-2-carbonitrile
IUPAC: 6-methylpyridine-2-carbonitrile
English name: 6-Methylpyridine-2-carbonitrile
Molecular formula: C7H6N2
Molecular weight: 118.14

Names & synonyms

6-Methylpyridine-2-carbonitrileEINECS 216-588-9NSC 26022DTXSID60167284RefChem:544035DTXCID0089775216-588-91620-75-36-Methylpicolinonitrile2-CYANO-6-METHYLPYRIDINE6-Methyl-2-pyridinecarbonitrile2-Pyridinecarbonitrile, 6-methyl-

Show more names

6-Cyanopicoline6-Cyano-2-picolineCyano-6-Methylpyrid2-Cyano-6-methlypyridine6-METHYL PICOLINONITRILE

6-methyl-pyridine-2-carbonitrileMFCD001905862-Methyl-6-cyanopyridine6-methyl-2-cyanopyridine6-Cyano-2-methylpyridine2-Cyano-6-methyl pyridineNSC-26022CS-W002490

Database identifiers

CAS: 1620-75-3
PubChem CID: 74182
DTXSID: DTXSID60167284
UNII: WU7ECL97NB
EC Number: 216-588-9
Nikkaji: J149.541K

Properties

Computed structural properties

XLogP: 0.8
Topological polar surface area: 36.7 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 0
Heavy atoms: 9
Formal charge: 0
Complexity: 133

Experimental & physicochemical properties

LogP0.84

Physicochemical properties

Melting point: 70 · 70-74 °C(lit.)
Boiling point: 0 °C · 0°C
Density: 1.08 · 1.08±0.1 g/cm3(Predicted)
Flash point: 0 °C · 0°C
storage temp.: Inert atmosphere,Room Temperature
solubility: Dichloromethane, Hexane
pka: 0.4 · 0.40±0.10(Predicted)
form: Solid
color: Off-white
InChI: 1S/C7H6N2/c1-6-3-2-4-7(5-8)9-6/h2-4H,1H3
InChIKey: CMADFEQMYFNYCF-UHFFFAOYSA-N
SMILES: Cc1cccc(n1)C#N
CAS DataBase Reference: 1620 · 1620-75-3(CAS DataBase Reference)
UNSPSC Code: 12352100 · 12352100
NACRES: 22 · NA.22
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319-H335
Precautionary statements: 261 · P261-P264-P271-P280-P302+P352-P305+P351+P338
target organs: Respiratory system
PPE: 95 · dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes: Xi
Risk Statements: 36 · 36/37/38
Safety Statements: 26 · 26-36
RIDADR: 3439 · UN 3439 6.1/PG III
WGK Germany: 3 · 3
HazardClass: 6.1 · 6.1
PackingGroup: III
HS Code: 29333990 · 29333990
Storage Class: 11 · 11 - Combustible Solids
Hazard Classifications: 2 Skin · Eye Irrit. 2Skin Irrit. 2STOT SE 3

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 41 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

PPE: dust mask type N95 (US), Eyeshields, Gloves
wgk: 3
ridadr: UN 3439 6.1/PG III
hs_code: 29333990
risk_code: 36/37/38
Signal word: Warning
Symbol(GHS): GHS07
hazard_code: Xi
safety_code: 26-36
hazard_class: 6.1
Storage Class: 11 - Combustible Solids
packing_group: III
target organs: Respiratory system
Hazard statements: H315-H319-H335
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3
Precautionary statements: P261-P264-P271-P280-P302+P352-P305+P351+P338

Chemistry & industry

Applications

Uses6-Methyl-2-pyridinecarbonitrile was used in the synthesis of zinc complexes bearing N,N′-bidentate entiopure ligands.

UsesIntermediate in the preparation of selective cyclooxygenase-2 inhibitors and calcium antagonists

Upstream & downstream products

Upstream raw materials

Downstream products

2-Pyridinecarboximidic acid, 6-methyl-, hydrazide 6-methylpyridine-2-thioamide 6-Methyl-4-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)picolinonitrile N'-Hydroxy-6-methylpyridine-2-carboximidamide 1-Propanone,1-(6-methyl-2-pyridinyl)-(9CI)2-Pyridinecarboximidamide,6-methyl-(9CI)

Suppliers100 total

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]

上海策嵘生物科技有限公司[email protected]

Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

韶远科技（上海）有限公司021-50795510 4000665055 · [email protected]

Related reactions

28 records

New reaction record

HRID 52347As reactantuspto-grants-1997_04

HRID 60804As reactantuspto-grants-2016_09

HRID 177570As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)

HRID 295662As reactantTraining data from https://doi.org/10.1039/C8SC04228D (8/10)

HRID 405774As reactantuspto-grants-2014_06

HRID 499384As reactantuspto-grants-2010_08

HRID 570291As reactantuspto-grants-2015_05

HRID 572916As reactantuspto-grants-2015_05

Compound notes

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Basic information