5-(Aminomethyl)-2-chlorophenylboronic Acid Pinacol Ester - CAS 1544673-71-3

Catalog:	BB011015
Product Name:	5-(Aminomethyl)-2-chlorophenylboronic Acid Pinacol Ester
CAS:	1544673-71-3
Synonyms:	[4-chloro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanamine; [4-chloro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanamine

Technical Data

IUPAC Name:	[4-chloro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanamine
Description:	5-(Aminomethyl)-2-chlorophenylboronic Acid Pinacol Ester (CAS# 1544673-71-3 ) is a useful research chemical.
Molecular Weight:	267.56
Molecular Formula:	C13H19ClNO2B
Canonical SMILES:	B1(OC(C(O1)(C)C)(C)C)C2=C(C=CC(=C2)CN)Cl
InChI:	InChI=1S/C13H19BClNO2/c1-12(2)13(3,4)18-14(17-12)10-7-9(8-16)5-6-11(10)15/h5-7H,8,16H2,1-4H3
InChI Key:	ZCLXMFHHNHWENK-UHFFFAOYSA-N

Complexity:	295
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	267.1197367
Formal Charge:	0
Heavy Atom Count:	18
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	267.1197367
Rotatable Bond Count:	2
Topological Polar Surface Area:	44.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0