4-Chloro-3-nitrophenylboronic Acid Pinacol Ester - CAS 913836-26-7

Name: 4-Chloro-3-nitrophenylboronic Acid Pinacol Ester
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB040161
Product Name:	4-Chloro-3-nitrophenylboronic Acid Pinacol Ester
CAS:	913836-26-7
Synonyms:	2-(4-chloro-3-nitrophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane; 2-(4-chloro-3-nitrophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Technical Data

IUPAC Name:	2-(4-chloro-3-nitrophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Description:	4-Chloro-3-nitrophenylboronic Acid Pinacol Ester (CAS# 913836-26-7) is a useful research chemical.
Molecular Weight:	283.52
Molecular Formula:	C12H15ClNO4B
Canonical SMILES:	B1(OC(C(O1)(C)C)(C)C)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]
InChI:	InChI=1S/C12H15BClNO4/c1-11(2)12(3,4)19-13(18-11)8-5-6-9(14)10(7-8)15(16)17/h5-7H,1-4H3
InChI Key:	VEIRGLFECZUCTI-UHFFFAOYSA-N
Boiling Point:	375.1 °C at 760 mmHg
Density:	1.24 g/cm³
MDL:	MFCD08235086
LogP:	3.07060

Complexity:	355
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	283.0782658000001
Formal Charge:	0
Heavy Atom Count:	19
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	283.0782658000001
Rotatable Bond Count:	1
Topological Polar Surface Area:	64.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0