Picolinoyl Chloride Hydrochloride (HCID 135033)

Names & identifiers

Preferred name: Picolinoyl Chloride Hydrochloride
IUPAC: pyridine-2-carbonyl chloride;hydrochloride
English name: Pyridine-2-carbonyl chloride hydrochloride
Molecular formula: C6H5Cl2NO
Molecular weight: 178.01

Names & synonyms

Picolinoyl chloride hydrochlorideRefChem:863123675-819-539901-94-5Pyridine-2-carbonyl Chloride Hydrochloride2-Pyridinecarbonyl chloride, hydrochlorideMFCD00060193pyridine-2-carbonyl chloride;hydrochlorideSCHEMBL337642picolinoyl chloride hy-drochloridePicolinoyl chloride, hydrochloride2-picolinoyl chloride hydrochloride

Show more names

Nsc254051JACS-39901-94-5Pyridine-2-CarbonylPyridine-2-carbonylchlorideHClPyridin-2-carbonyl chloride HClPyridine-2-formyl chloride hydrochloride5-Bromo-75-fluorobenzylamine&hydrochloridePyridine-2-carbonylChlorideHydrochloride>

picolinic acid chloride hydrochlorideCS-W008415NSC-254051BP-10679Picolinoyl chlori2-Pyridinecarbonyl Chloride Hydrochloride; 2-Picolinoyl Chloride Hydrochloride; 2-Pyridinoyl Chloride Hydrochloride; Picolinic Acid Chloride Hydrochloride; Picolinoyl Chloride Hydrochloride;NSC 254051PYRIDINE-2-CARBONYL CHLORIDE HCL

Database identifiers

CAS: 39901-94-5
PubChem CID: 135033
DTXSID: DTXSID60192955
UNII: KJ79PL9X87
EC Number: 675-819-5

Properties

Computed structural properties

Topological polar surface area: 30 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 1
Heavy atoms: 10
Formal charge: 0
Complexity: 116

Physicochemical properties

Melting point: 123 °C · 123°C
storage temp.: 2 · Inert atmosphere,2-8°C
form: powder to crystal
color: White to Gray to Red
InChI: InChI=1S/C6H4ClNO.ClH/c7-6(9)5-3-1-2-4-8-5;/h1-4H;1H
InChIKey: VIPHVHVAGBKHGR-UHFFFAOYSA-N
SMILES: C(C1N=CC=CC=1)(=O)Cl.Cl
CAS DataBase Reference: 39901 · 39901-94-5(CAS DataBase Reference)
FDA UNII: 79 PL9X87 · KJ79PL9X87
UNSPSC Code: 12352200 · 12352200
Symbol(GHS): 5 · GHS05
Signal word: Danger
Hazard statements: 290 · H290-H314
Precautionary statements: 234 · P234-P260-P264-P280-P301+P330+P331+P310-P303+P361+P353+P310+P363-P304+P340+P310-P305+P351+P338+P310-P390-P405-P406-P501
Hazard Codes: Xn
Risk Statements: 34 · 34-36-22
Safety Statements: 26 · 26-36/37/39
RIDADR: 1759 · 1759
WGK Germany: 3 · WGK 3
HazardClass: 8 · 8
PackingGroup: II
HS Code: 2933399990 · 2933399990
Storage Class: 11 · 11 - Combustible Solids
Limited Quantities: 5 kg · 5.0 kg (11 lbs) (solid)
Excepted Quantities: Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H302 (90.7%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, P264, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 43 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 CategoriesAcute Tox. 4 (90.7%)

Safety data

wgk: WGK 3
ridadr: 1759
hs_code: 2933399990
risk_code: 34-36-22
Signal word: Danger
Symbol(GHS): GHS05
hazard_code: Xn
safety_code: 26-36/37/39
hazard_class: 8
Storage Class: 11 - Combustible Solids
packing_group: II
Hazard statements: H290-H314
Limited Quantities: 5.0 kg (11 lbs) (solid)
Excepted Quantities: Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
Precautionary statements: P234-P260-P264-P280-P301+P330+P331+P310-P303+P361+P353+P310+P363-P304+P340+P310-P305+P351+P338+P310-P390-P405-P406-P501

Chemistry & industry

Applications · 1 item

UsesPyridine-2-carbonyl chloride hydrochloride is used in the synthetic preparation of various pharmaceutical goods. Pyridine-2-carbonyl chloride hydrochloride is also used for the synthesis of active esters of isonicotinic (I821760) and picolinic acids (P437220).