1-Cyclopropyl-4-iodopyrazole - CAS 1239363-40-6

Catalog:	BB005761
Product Name:	1-Cyclopropyl-4-iodopyrazole
CAS:	1239363-40-6
Synonyms:	1-cyclopropyl-4-iodopyrazole; 1-cyclopropyl-4-iodopyrazole

Technical Data

Patents

Computed Properties

IUPAC Name:	1-cyclopropyl-4-iodopyrazole
Description:	1-Cyclopropyl-4-iodopyrazole (CAS# 1239363-40-6) is a useful chemical for the preparation of dihydropyridinone MGAT2 inhibitor.
Molecular Weight:	234.04
Molecular Formula:	C6H7IN2
Canonical SMILES:	C1CC1N2C=C(C=N2)I
InChI:	InChI=1S/C6H7IN2/c7-5-3-8-9(4-5)6-1-2-6/h3-4,6H,1-2H2
InChI Key:	JBWOMLVMUQFTFQ-UHFFFAOYSA-N
Appearance:	Pale-yellow to yellow-brown liquid
Storage:	Keep in dark place, Sealed in dry, 2-8 °C
LogP:	1.82260

Publication Number	Title	Priority Date
WO-2021080929-A1	N-(heteroaryl) quinazolin-2-amine derivatives as lrrk2 inhibitors, pharmaceutical compositions, and uses thereof	20191025
WO-2021032209-A1	Anti-influenza virus compound, preparation method and use thereof	20190822
CN-112194659-A	Alkyne derivative and preparation method and application thereof	20190708
WO-2021004421-A1	Alkyne derivative, preparation method for same, and uses thereof	20190708
WO-2020249664-A1	Sulfonylurea derivatives and uses thereof	20190612

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Complexity:	114
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	233.9654
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	233.9654
Rotatable Bond Count:	1
Topological Polar Surface Area:	17.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.3