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ChemicalBook--->CAS DataBase List--->39178-35-3

39178-35-3

39178-35-3 Structure

39178-35-3 Structure
IdentificationMore
[Name]

ISONICOTINOYL CHLORIDE HYDROCHLORIDE
[CAS]

39178-35-3
[Synonyms]

4-PYRIDINOYL CHLORIDE HYDROCHLORIDE
ISONICOTINOYL CHLORIDE HYDROCHLORIDE
ISONICOTINYL CHLORIDE HYDROCHLORIDE
PYRIDINE-4-CARBONYL CHLORIDE HYDROCHLORIDE
TIMTEC-BB SBB003768
pyridine-4-carbonyl chloride
ISONICOTINOYL CHLORIDE HYDROCHLORIDE, 95 %
Pyridine-4-carbonylchlorideHCl
IsonicotinoylchlorideHCl
4-Pyridinecarbonyl chloride hydrochloride
Isonicotinic acid chloride·hydrochloride
[EINECS(EC#)]

254-331-2
[Molecular Formula]

C6H5Cl2NO
[MDL Number]

MFCD00012830
[Molecular Weight]

178.02
[MOL File]

39178-35-3.mol
Chemical PropertiesBack Directory
[Appearance]

almost white to beige crystalline powder
[Melting point ]

159-161 °C(lit.)
[storage temp. ]

Inert atmosphere,Room Temperature
[solubility ]

methanol: soluble50mg/mL, clear to hazy, colorless to light yellow
[form ]

Crystalline Powder
[color ]

Almost white to beige
[Water Solubility ]

almost transparency
[Sensitive ]

Moisture Sensitive
[BRN ]

3626052
[InChI]

InChI=1S/C6H4ClNO.ClH/c7-6(9)5-1-3-8-4-2-5;/h1-4H;1H
[InChIKey]

BNTRVUUJBGBGLZ-UHFFFAOYSA-N
[SMILES]

C1(C(Cl)=O)=CC=NC=C1.Cl
[CAS DataBase Reference]

39178-35-3(CAS DataBase Reference)
[Storage Precautions]

Moisture sensitive
Questions And AnswerBack Directory
[Uses]

Isonicotinyl Chloride Hydrochloride, is a heterocyclic building block used for the synthesis of various pharmaceutical and biologically active compounds. It can be used for the preparation of Tetrahydropyrroloquinolinone type dual inhibitors of Aromatase/Aldosterone Synthase, as a novel stagey for breast cancer patients with the risk of cardiovascular diseases.
Safety DataBack Directory
[Hazard Codes ]

C
[Risk Statements ]

R34:Causes burns.
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
[RIDADR ]

UN 3261 8/PG 2
[WGK Germany ]

3
[Hazard Note ]

Corrosive
[HazardClass ]

8
[PackingGroup ]

II
[HS Code ]

29333990
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Ethanol-->Diethyl ether-->Sulfuric acid-->Dichloromethane-->Thionyl chloride-->Toluene-->Sodium chloride-->Isonicotinic acid-->Isonicotinic acid chloride
[Preparation Products]

propane-1,3-diyl diisonicotinate-->PYRIDINE-4-CARBOXYLIC ACID PENTAFLUOROPHENYL ESTER-->N-[2-(pyridine-4-carbonylamino)ethyl]pyridine-4-carboxamide-->4-Pyridinecarboxylic acid, 4,4'-(1,4-phenylene) ester-->but-2-yne-1,4-diyl diisonicotinate-->N-(4-Acetylphenyl)isonicotinamide-->tert-Butyl 4-(isonicotinamido)piperidine-1-carboxylate-->N-[(R)-9-METHYL-4-OXO-1-PHENYL-3,4,6,7-TETRAHYDRO[1,4]DIAZEPINO[6,7,1-HI]INDOL-3-YL]ISONICOTINAMIDE-->Methyl 2-(pyridin-4-yl)-1,3-benzoxazole-7-carboxylate
Hazard InformationBack Directory
[Chemical Properties]

almost white to beige crystalline powder
Spectrum DetailBack Directory
[Spectrum Detail]

ISONICOTINOYL CHLORIDE HYDROCHLORIDE(39178-35-3)MS
ISONICOTINOYL CHLORIDE HYDROCHLORIDE(39178-35-3)1HNMR
ISONICOTINOYL CHLORIDE HYDROCHLORIDE(39178-35-3)IR1
ISONICOTINOYL CHLORIDE HYDROCHLORIDE(39178-35-3)IR2
ISONICOTINOYL CHLORIDE HYDROCHLORIDE(39178-35-3)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

Isonicotinoyl chloride hydrochloride, 97%(39178-35-3)
[Alfa Aesar]

Isonicotinoyl chloride hydrochloride, 98%(39178-35-3)
[Sigma Aldrich]

39178-35-3(sigmaaldrich)
[TCI AMERICA]

Isonicotinoyl Chloride Hydrochloride,>95.0%(T)(39178-35-3)
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