4-(4-Methyl-1-piperazinyl)phenylboronic Acid - CAS 229009-40-9

Name: 4-(4-Methyl-1-piperazinyl)phenylboronic Acid
Brand: BOC Sciences
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Catalog:	BB017801
Product Name:	4-(4-Methyl-1-piperazinyl)phenylboronic Acid
CAS:	229009-40-9
Synonyms:	[4-(4-methyl-1-piperazinyl)phenyl]boronic acid; [4-(4-methylpiperazin-1-yl)phenyl]boronic acid

Technical Data

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Computed Properties

IUPAC Name:	[4-(4-methylpiperazin-1-yl)phenyl]boronic acid
Description:	4-(4-Methyl-1-piperazinyl)phenylboronic Acid (CAS# 229009-40-9) is a useful synthetic compound.
Molecular Weight:	220.08
Molecular Formula:	C11H17N2O2B
Canonical SMILES:	B(C1=CC=C(C=C1)N2CCN(CC2)C)(O)O
InChI:	InChI=1S/C11H17BN2O2/c1-13-6-8-14(9-7-13)11-4-2-10(3-5-11)12(15)16/h2-5,15-16H,6-9H2,1H3
InChI Key:	LSKYURVDOIDSCG-UHFFFAOYSA-N
Boiling Point:	406.2 °C at 760 mmHg
Density:	1.2 g/cm³
Appearance:	Solid
MDL:	MFCD11223486
LogP:	-0.87890

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Related Functional Groups

Boronic Acids and Esters

[380430-53-5]C9H11O4B
2-Ethoxycarbonylphenylboronic Acid
[364044-44-0]C12H10ClO2B
4'-Chloro-4-biphenylboronic Acid
[2005430-90-8]C18H30N3O3BSi
3-[[2-(Trimethylsilyl)ethoxy]methyl]-3H-imidazo[4,5-b]pyridine-6-boronic Acid Pinacol Ester
[1256358-61-8]C10H15O4B
3-[(2-Methoxyethoxy)methyl]phenylboronic Acid
[82954-89-0]C8H17O2B
Ethylboronic Acid Pinacol Ester
[347389-74-6]C8H13O2B
Ethynylboronic Acid Pinacol Ester

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Complexity:	212
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	220.138308
Formal Charge:	0
Heavy Atom Count:	16
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	220.138308
Rotatable Bond Count:	2
Topological Polar Surface Area:	46.9
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0