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4-Chloropyridine hydrochloride

HCID 81852
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
7379-35-3
Standard SMILES
Cl.Clc1ccncc1
InChIKey
XGAFCCUNHIMIRV-UHFFFAOYSA-N
Molecular formula
C5H5Cl2N
Average molar mass
150 g/mol
Monoisotopic mass
148.97990452

Names & identifiers

Preferred name
4-Chloropyridine hydrochloride
IUPAC
4-chloropyridine;hydrochloride
English name
4-Chloropyridinium chloride
Molecular formula
C5H4ClN.ClH
Molecular weight
150.01

Names & synonyms

4-Chloropyridine hydrochloride7379-35-3Pyridine, 4-chloro-, hydrochlorideNSC 78418CCRIS 1716EINECS 230-946-1Pyridine, 4-chloro-, hydrochloride (1:1)DTXSID7064651RefChem:98616DTXCID0047589Pyridine, 4chloro, hydrochloride230-946-1
Show more names
4-Chloropyridine hydrochloride 4-Chloropyridinium chloride4-CHLOROPYRIDINE HYDROCHLORIDE 4-CHLORO-PYRIDINE HYDROCHLORIDERARECHEM AH CK 00744-Chloropyridinium coropyridine HydrochLCHLOROPYRIDINE(4-) HCLTH 336 (Hydrochloride)4-Chlorpyridinhydrochlorid
4-CHLOROPYRIDINE HCl4-Chloropyridinium chloride4-chloropyridine;hydrochloride4-chloro-pyridine hydrochlorideMFCD000128294-chloropyridine-HClNSC-784184chloropyridine hydrochloride

Database identifiers

CAS
7379-35-3
PubChem CID
81852
DTXSID
DTXSID7064651
UNII
MQ68UJ9S26
EC Number
230-946-1

Properties

Computed structural propertiesFilling in

Topological polar surface area
12.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
0
Heavy atoms
8
Formal charge
0
Complexity
50

Experimental & physicochemical properties

Chemical ClassesNitrogen Compounds -> Pyridines
Physical DescriptionOff-white powder with a mild odor; [Alfa Aesar MSDS]

Physicochemical properties

Melting point
210 °C · 210 °C (subl.)(lit.)
Boiling point
147 ℃[at · 147℃[at 101 325 Pa]
vapor pressure
7.666 hPa · 7.666hPa at 25℃
Flash point
198 °C · 198 °C
storage temp.
Keep in dark place,Inert atmosphere,Room temperature
solubility
soluble in DMSO, Methanol, Water
form
Crystalline Powder
color
Off-white to yellow-beige
PH
2 · 2.0 (100g/l, H2O, 20℃)
Water Solubility
Soluble in water.
BRN
3684904 · 3684904

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Warning

H302 (56%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 100 reports by companies from 11 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Regulatory Information · 2 items

Status: Active Update: 04-09-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/25403

4-Chloropyridinium chloride: Does not have an individual approval but may be used under an appropriate group standard

Hazards SummaryA mild skin and strong eye irritant; Harmful by ingestion; [Alfa Aesar MSDS]
Hazard Classes and CategoriesAcute Tox. 4 (56%)

Safety data

PPE
dust mask type N95 (US), Eyeshields, Gloves
wgk
3
tsca
TSCA listed
rtecs
US6300000
ridadr
UN2811
hs_code
29333999
risk_code
22-36/37/38-36/38-20/21/22
Signal word
Warning
Symbol(GHS)
GHS07

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationPyridine, 4-chloro-, hydrochloride (1:1): ACTIVE

Applications

UsesIt is employed as a catalyst in the synthesis of fluorazone derivatives by one-pot pyrrolation/cyclization of anthranilic acids.

Upstream & downstream products

Downstream products

4-Chloronicotinic acid(4-Methoxy-1H-pyrrolo[2,3-b]pyridin-2-yl)methanol2-(4-Methoxy-1H-pyrrolo[2,3-b]pyridin-2-yl)ethanamine4-Methoxy-3-pyridinecarboxaldehyde4-Methoxy-1H-pyrrolo[2,3-b]pyridine-2-carbaldehyde4-Chloropyridine-3-carboxaldehydeEthyl 4-methoxy-1H-pyrrolo[2,3-b]pyridine-2-carboxylate4-chloropyridine4-Chloro-3-iodopyridine4-Chloropyridin-3-ylboronic acid, pinacol ester 984-Phenoxypyridine

Related reactions

234 records
New reaction record
HRID 927 reaction equation
HRID 927As reactantuspto-grants-1998_03
HRID 2207 reaction equation
HRID 2207As reactantuspto-grants-1998_03
HRID 2230 reaction equation
HRID 2230As reactantuspto-grants-1998_03
HRID 2237 reaction equation
HRID 2237As reactantuspto-grants-1998_03
HRID 2242 reaction equation
HRID 2242As reactantuspto-grants-1998_03
HRID 5891 reaction equation
HRID 5891As reactantuspto-grants-1993_09
HRID 16699 reaction equation
HRID 16699As reactantuspto-grants-2010_06
HRID 21558 reaction equation
HRID 21558As reactantuspto-grants-1995_06
Page 1 of 30

Compound notes

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InChI
InChI=1S/C5H4ClN.ClH/c6-5-1-3-7-4-2-5;/h1-4H;1H
InChIKey
XGAFCCUNHIMIRV-UHFFFAOYSA-N
SMILES
C1=NC=CC(Cl)=C1.[H]Cl
CAS DataBase Reference
7379 · 7379-35-3(CAS DataBase Reference)
EPA Substance Registry System
4 · 4-Chloropyridine hydrochloride (7379-35-3)
UNSPSC Code
12352100 · 12352100
NACRES
22 · NA.22
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H319
Precautionary statements
264 · P264-P270-P280-P301+P312-P305+P351+P338-P337+P313
PPE
95 · dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes
Xn,Xi
Risk Statements
22 · 22-36/37/38-36/38-20/21/22
Safety Statements
26 · 26-9-27-36/37/39-36
RIDADR
2811 · UN2811
WGK Germany
3 · 3
RTECS
6300000 · US6300000
TSCA
TSCA listed
HazardClass
IRRITANT
PackingGroup
III
HS Code
29333999 · 29333999
Storage Class
11 · 11 - Combustible Solids
Hazard Classifications
4 OralEye · Acute Tox. 4 OralEye Irrit. 2
REACH Registrations
Active
hazard_code
Xn,Xi
safety_code
26-9-27-36/37/39-36
hazard_class
IRRITANT
Storage Class
11 - Combustible Solids
packing_group
III
Hazard statements
H302-H319
REACH Registrations
Active
Hazard Classifications
Acute Tox. 4 OralEye Irrit. 2
Precautionary statements
P264-P270-P280-P301+P312-P305+P351+P338-P337+P313
N-octylpyridin-4-amine
4-Phenylpyridine
2-Propyn-1-ol, 3-(4-pyridinyl)- (9CI)
N,N-Dipropylpyridin-4-AMine