2-Chloro-5-propoxyphenylboronic Acid - CAS 1256346-14-1

Catalog:	BB006157
Product Name:	2-Chloro-5-propoxyphenylboronic Acid
CAS:	1256346-14-1
Synonyms:	(2-chloro-5-propoxyphenyl)boronic acid; (2-chloro-5-propoxyphenyl)boronic acid

Technical Data

Patents

Computed Properties

IUPAC Name:	(2-chloro-5-propoxyphenyl)boronic acid
Description:	2-Chloro-5-propoxyphenylboronic Acid (CAS# 1256346-14-1) is a useful research chemical.
Molecular Weight:	214.45
Molecular Formula:	C9H12ClO3B
Canonical SMILES:	B(C1=C(C=CC(=C1)OCCC)Cl)(O)O
InChI:	InChI=1S/C9H12BClO3/c1-2-5-14-7-3-4-9(11)8(6-7)10(12)13/h3-4,6,12-13H,2,5H2,1H3
InChI Key:	ZCCYRXLLDQAMRN-UHFFFAOYSA-N
MDL:	MFCD16295074
LogP:	0.80860

Publication Number	Title	Priority Date
EP-2558577-A1	Bi-functional complexes and methods for making and using such complexes	20100416
WO-2011127933-A1	Bi-functional complexes and methods for making and using such complexes	20100416

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Related Functional Groups

Boronic Acids and Esters

[2454490-85-6]
2-(7,8-Difluoro-1-naphthyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
[1256355-43-7]
2-(Methoxycarbonyl)-4-methylphenylboronic Acid
[881302-73-4]
3,5-Dicarboxyphenylboronic Acid
[470478-90-1]
4-(4-Boc-piperazino)phenylboronic Acid Pinacol Ester
[1967833-52-8]
4-(4-Piperidyl)phenylboronic Acid
[2246646-61-5]
2-(3-((4-Bromo-2-chlorophenoxy)methyl)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Complexity:	168
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	214.0568021
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	214.0568021
Rotatable Bond Count:	4
Topological Polar Surface Area:	49.7
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0