3-Benzyloxy-5-bromopyridine - CAS 130722-95-1

Catalog:	BB007159
Product Name:	3-Benzyloxy-5-bromopyridine
CAS:	130722-95-1
Synonyms:	3-bromo-5-phenylmethoxypyridine; 3-bromo-5-phenylmethoxypyridine

Technical Data

Patents

Computed Properties

IUPAC Name:	3-bromo-5-phenylmethoxypyridine
Description:	3-Benzyloxy-5-bromopyridine (CAS# 130722-95-1) is a useful research chemical.
Molecular Weight:	264.12
Molecular Formula:	C12H10BrNO
Canonical SMILES:	C1=CC=C(C=C1)COC2=CC(=CN=C2)Br
InChI:	InChI=1S/C12H10BrNO/c13-11-6-12(8-14-7-11)15-9-10-4-2-1-3-5-10/h1-8H,9H2
InChI Key:	YSHKYZAWTWKQKK-UHFFFAOYSA-N
Boiling Point:	343.7 °C at 760 mmHg
Density:	1.438 g/cm³
MDL:	MFCD07375004
LogP:	3.42310

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Complexity:	183
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	262.99458
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	262.99458
Rotatable Bond Count:	3
Topological Polar Surface Area:	22.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3