4-Amino-6-methylnicotinic Acid - CAS 127915-50-8

Catalog:	BB006839
Product Name:	4-Amino-6-methylnicotinic Acid
CAS:	127915-50-8
Synonyms:	4-amino-6-methyl-3-pyridinecarboxylic acid; 4-amino-6-methylpyridine-3-carboxylic acid

Technical Data

Patents

Computed Properties

IUPAC Name:	4-amino-6-methylpyridine-3-carboxylic acid
Description:	4-Amino-6-methylnicotinic Acid (CAS# 127915-50-8) is a useful research chemical.
Molecular Weight:	152.15
Molecular Formula:	C7H8N2O2
Canonical SMILES:	CC1=NC=C(C(=C1)N)C(=O)O
InChI:	InChI=1S/C7H8N2O2/c1-4-2-6(8)5(3-9-4)7(10)11/h2-3H,1H3,(H2,8,9)(H,10,11)
InChI Key:	WUSQVMYMTQCNAV-UHFFFAOYSA-N
Boiling Point:	385.469 °C at 760 mmHg
Density:	1.338 g/cm³
Storage:	Keep in dark place, Inert atmosphere, Room temperature
MDL:	MFCD12923129
LogP:	1.25160

Publication Number	Title	Priority Date
CA-3085255-A1	Eif4e-inhibiting compounds and methods	20190702
WO-2021003157-A1	Eif4e-inhibiting 4-oxo-3,4-dihydropyrido[3,4-d]pyrimidine compounds	20190702
CN-103497151-A	Synthetic method of 4-amidogen-6-methylnicotinicacid	20131030
CN-103497151-B	Synthetic method of 4-amidogen-6-methylnicotinicacid	20131030
EP-2696682-B1	Mif inhibitors and their uses	20110413

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Complexity:	161
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	152.058577502
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	152.058577502
Rotatable Bond Count:	1
Topological Polar Surface Area:	76.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.6