2-chloro-5-iodopyrimidine - CAS 32779-38-7

Catalog:	BB021409
Product Name:	2-chloro-5-iodopyrimidine
CAS:	32779-38-7
Synonyms:	2-chloro-5-iodopyrimidine; 2-chloro-5-iodopyrimidine

Technical Data

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Computed Properties

IUPAC Name:	2-chloro-5-iodopyrimidine
Description:	2-chloro-5-iodopyrimidine (CAS# 32779-38-7) is a useful research chemical.
Molecular Weight:	240.43
Molecular Formula:	C4H2ClIN2
Canonical SMILES:	C1=C(C=NC(=N1)Cl)I
InChI:	InChI=1S/C4H2ClIN2/c5-4-7-1-3(6)2-8-4/h1-2H
InChI Key:	WSZRCNZXKKTLQE-UHFFFAOYSA-N
Boiling Point:	317.8 °C at 760 mmHg
Purity:	97 %
Density:	2.187 g/cm³
LogP:	1.73460

Publication Number	Title	Priority Date
WO-2021057853-A1	Aza-quinoline compounds and uses thereof	20190926
WO-2021025976-A1	Substituted cyclopropyl-2,2'-bipyrimidinyl compounds, analogues thereof, and methods using same	20190802
WO-2020179443-A1	Laminate for high-frequency circuit, method for producing same, flexible printed board, b stage sheet, and wound laminate	20190301
TW-202102575-A	Laminated body for high frequency circuit and manufacturing method thereof, flexible printed circuit board, B-stage sheet, and laminated body wound body	20190301
CN-111484482-A	Alkynyl pyrimidine or alkynyl pyridine compound, and composition and application thereof	20190129

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GHS Hazard Statement:	H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P264, P270, P280, P301+P312, P302+P352, P305+P351+P338, P321, P330, P332+P313, P337+P313, P362, and P501
Signal Word:	Warning

Complexity:	72.4
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	239.89512
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	239.89512
Rotatable Bond Count:	0
Topological Polar Surface Area:	25.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.8