Methyl 5-Hydroxypyrimidine-2-carboxylate - CAS 1415574-30-9

Catalog:	BB009193
Product Name:	Methyl 5-Hydroxypyrimidine-2-carboxylate
CAS:	1415574-30-9
Synonyms:	5-hydroxy-2-pyrimidinecarboxylic acid methyl ester; methyl 5-hydroxypyrimidine-2-carboxylate

Technical Data

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Computed Properties

IUPAC Name:	methyl 5-hydroxypyrimidine-2-carboxylate
Description:	Methyl 5-Hydroxypyrimidine-2-carboxylate (CAS# 1415574-30-9 ) is a useful research chemical.
Molecular Weight:	154.12
Molecular Formula:	C6H6N2O3
Canonical SMILES:	COC(=O)C1=NC=C(C=N1)O
InChI:	InChI=1S/C6H6N2O3/c1-11-6(10)5-7-2-4(9)3-8-5/h2-3,9H,1H3
InChI Key:	BEZDJOOHPCJDAY-UHFFFAOYSA-N

Publication Number	Title	Priority Date
AU-2018358346-A1	Modulators of the integrated stress pathway	20171102
TW-201932447-A	Integrating stress pathway regulator	20171102
WO-2019090069-A1	Modulators of the integrated stress pathway	20171102
BR-112020008841-A2	modulators of the integrated stress pathway	20171102
EP-3704094-A1	Modulators of the integrated stress pathway	20171102

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	143
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	154.03784206
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	154.03784206
Rotatable Bond Count:	2
Topological Polar Surface Area:	72.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-1.1