2,4,6-Trichloro-5-methoxypyrimidine - CAS 60703-46-0

Catalog:	BB030779
Product Name:	2,4,6-Trichloro-5-methoxypyrimidine
CAS:	60703-46-0
Synonyms:	2,4,6-trichloro-5-methoxypyrimidine; 2,4,6-trichloro-5-methoxypyrimidine

Technical Data

Patents

Computed Properties

IUPAC Name:	2,4,6-trichloro-5-methoxypyrimidine
Description:	2,4,6-Trichloro-5-methoxypyrimidine (CAS# 60703-46-0) is a useful research chemical.
Molecular Weight:	213.45
Molecular Formula:	C5H3Cl3N2O
Canonical SMILES:	COC1=C(N=C(N=C1Cl)Cl)Cl
InChI:	InChI=1S/C5H3Cl3N2O/c1-11-2-3(6)9-5(8)10-4(2)7/h1H3
InChI Key:	BXDZWBOGMCNUSE-UHFFFAOYSA-N
Boiling Point:	255.2 °C at 760 mmHg
Density:	1.572 g/cm³
LogP:	2.44540

Publication Number	Title	Priority Date
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Complexity:	125
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	211.931096
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	211.931096
Rotatable Bond Count:	1
Topological Polar Surface Area:	35
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.1