6-Aminonicotinaldehyde - CAS 69879-22-7

Catalog:	BB034002
Product Name:	6-Aminonicotinaldehyde
CAS:	69879-22-7
Synonyms:	6-amino-3-pyridinecarboxaldehyde; 6-aminopyridine-3-carbaldehyde

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	6-aminopyridine-3-carbaldehyde
Description:	6-Aminonicotinaldehyde (CAS# 69879-22-7) is a novel ribonucleotide reductase inhibitor that belongs to the class of metal-binding site affecting ribonucleotide inhibitors that are derivatives of alpa-heterocyclic carboxaldehyde thiosemicarbazone.
Molecular Weight:	122.12
Molecular Formula:	C6H6N2O
Canonical SMILES:	C1=CC(=NC=C1C=O)N
InChI:	InChI=1S/C6H6N2O/c7-6-2-1-5(4-9)3-8-6/h1-4H,(H2,7,8)
InChI Key:	BMNPVMQSUPTGFD-UHFFFAOYSA-N
Boiling Point:	309 ℃ at 760 mmHg
Density:	1.264 g/cm³
LogP:	0.40640

Publication Number	Title	Priority Date
CN-113248500-A	Azaindolopyrimidineamine heterocyclic compounds, and preparation method and application thereof	20210610
CN-113248500-B	Azaindolopyrimidineamine heterocyclic compounds, and preparation method and application thereof	20210610
CN-113264920-A	CDK6 inhibitor of pyrimidine benzo six-membered ring parent nucleus and preparation method and application thereof	20210510
CN-113149978-A	Intermediate compound, preparation method and application thereof	20210204
CN-112390793-A	CDK6/DYRK2 double-target inhibitor and preparation method and application thereof	20210119

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Related Functional Groups

Carbonyl Compounds

[91125-43-8]
Sulfophenyl nonanoate sodium salt
[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[1427004-19-0]
DBCO-PEG4-NHS ester
[55441-25-3]
1-(2-Cyanophenyl)urea
[1035840-45-9]
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[832741-29-4]
1-(4-Bromo-5-propylthiophen-2-yl)ethanone

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:	105
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	122.048012819
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	122.048012819
Rotatable Bond Count:	1
Topological Polar Surface Area:	56 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0