5-Methoxypyrimidine - CAS 31458-33-0

Catalog:	BB020925
Product Name:	5-Methoxypyrimidine
CAS:	31458-33-0
Synonyms:	5-methoxypyrimidine; 5-methoxypyrimidine

Technical Data

Patents

Computed Properties

IUPAC Name:	5-methoxypyrimidine
Description:	5-Methoxypyrimidine (CAS# 31458-33-0) is a compound useful in organic synthesis.
Molecular Weight:	110.11
Molecular Formula:	C5H6N2O
Canonical SMILES:	COC1=CN=CN=C1
InChI:	InChI=1S/C5H6N2O/c1-8-5-2-6-4-7-3-5/h2-4H,1H3
InChI Key:	JIADELSANNMYFC-UHFFFAOYSA-N
Boiling Point:	181.7 °C at 760 mmHg
Density:	1.102 g/cm³
MDL:	MFCD04971313
LogP:	0.48520

Publication Number	Title	Priority Date
CN-111518715-A	Sulfonamide antibiotic synergistic degradation bacteria and application thereof	20200402
CN-111518715-B	Sulfonamide antibiotic synergistic degradation bacteria and application thereof	20200402
WO-2021094905-A1	1 -(4-(4-(5-phenyl-4,5-dihydroisoxazol-3-yl)thiazol-2-yl)piperidin-1 -yl)-ethan-1 -one derivatives and related compounds as fungicides for crop protection	20191111
KR-20210049374-A	Porous structure, methods of fabricating thereof and triboelectric generator using the same	20191025
CN-109400538-A	The preparation method of penoxsuam raw medicine related impurities bis-CHYMP	20181219

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Complexity:	61.4
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	110.048012819
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	110.048012819
Rotatable Bond Count:	1
Topological Polar Surface Area:	35
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.1