4-Amino-6-chloronicotinaldehyde - CAS 1001756-21-3

Catalog:	BB000117
Product Name:	4-Amino-6-chloronicotinaldehyde
CAS:	1001756-21-3
Synonyms:	4-amino-6-chloro-3-pyridinecarboxaldehyde; 4-amino-6-chloropyridine-3-carbaldehyde

Technical Data

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Computed Properties

IUPAC Name:	4-amino-6-chloropyridine-3-carbaldehyde
Description:	4-Amino-6-chloronicotinaldehyde (CAS# 1001756-21-3) is a useful research chemical.
Molecular Weight:	156.57
Molecular Formula:	C6H5ClN2O
Canonical SMILES:	C1=C(C(=CN=C1Cl)C=O)N
InChI:	InChI=1S/C6H5ClN2O/c7-6-1-5(8)4(3-10)2-9-6/h1-3H,(H2,8,9)
InChI Key:	CGMIFAMRODWNJB-UHFFFAOYSA-N
Appearance:	Pale-yellow to yellow-brown solid
Storage:	Keep in dark place, Inert atmosphere, 2-8 °C
LogP:	1.71090

Publication Number	Title	Priority Date
WO-2021158481-A1	Substituted 1,1'-biphenyl compounds and methods using same	20200203
WO-2020182062-A1	Fgfr4 kinase inhibitor, preparation method therefor and use thereof	20190308
CN-110857300-A	Condensed ring triazole compounds, preparation method and application	20180823
WO-2020038458-A1	Class of fused ring triazole compound, preparation method, and use	20180823
WO-2019085894-A1	Nitrogen-containing fused ring compound, preparation method therefor, and use thereof	20171030

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
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:	131
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	156.0090405
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	156.0090405
Rotatable Bond Count:	1
Topological Polar Surface Area:	56 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.1