4-Chloro-3-iodo-pyridin-2-ylamine - CAS 417721-69-8

Catalog:	BB024955
Product Name:	4-Chloro-3-iodo-pyridin-2-ylamine
CAS:	417721-69-8
Synonyms:	4-chloro-3-iodopyridin-2-amine

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	4-chloro-3-iodopyridin-2-amine
Description:	4-Chloro-3-iodo-pyridin-2-ylamine (CAS# 417721-69-8) is a useful research chemical.
Molecular Weight:	254.45
Molecular Formula:	C5H4ClIN2
Canonical SMILES:	C1=CN=C(C(=C1Cl)I)N
InChI:	InChI=1S/C5H4ClIN2/c6-3-1-2-9-5(8)4(3)7/h1-2H,(H2,8,9)
InChI Key:	BWMULFKDCVPGNF-UHFFFAOYSA-N
Boiling Point:	319.8 °C at 760 mmHg
Purity:	95 %
Density:	2.139 g/cm³
Appearance:	Yellow to brown solid
MDL:	MFCD08741521
LogP:	2.50300

Publication Number	Title	Priority Date
EP-3613738-A1	4-substituted pyrrolo[2,3-b]pyridine as erbb modulators useful for treating cancer	20180823
WO-2020039060-A1	4-substituted pyrrolo[2,3-b]pyridine as erbb modulators useful for treating cancer	20180823
AU-2019324528-A1	4-substituted pyrrolo(2,3-b)pyridine as ErbB modulators useful for treating cancer	20180823
CA-3105010-A1	4-substituted pyrrolo[2,3-b]pyridine as erbb modulators useful for treating cancer	20180823
CN-112585138-A	4-substituted pyrrolo [2,3-b ] pyridines as ErbB modulators useful in the treatment of cancer	20180823

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Related Functional Groups

Pyridines

[14993-80-7]
2-(6-Methylpyridin-2-yl)acetonitrile
[1261365-99-4]
2,5-Dichloro-6-(hydroxymethyl)pyridin-3-ol
[267242-99-9]
2-Chloro-4-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine
[2122800-15-9]
3-(Phenyl-4-D)-N,N-dimethyl-3-(2-pyridyl)-1-propanamine
[643762-61-2]
3-Bromo-2-(bromomethyl)-6-fluoropyridine
[1122-43-6]
3-Hydroxy-2,6-dimethylpyridine

GHS Hazard Statement:	H302+H312+H332 (97.44%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	101
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	253.91077
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	253.91077
Rotatable Bond Count:	0
Topological Polar Surface Area:	38.9 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.8