Octylboronic Acid - CAS 28741-08-4

Catalog:	BB019936
Product Name:	Octylboronic Acid
CAS:	28741-08-4
Synonyms:	octylboronic acid; octylboronic acid

Technical Data

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Computed Properties

IUPAC Name:	octylboronic acid
Description:	Octylboronic Acid (CAS# 28741-08-4) is a useful research chemical.
Molecular Weight:	158.05
Molecular Formula:	C8H19O2B
Canonical SMILES:	B(CCCCCCCC)(O)O
InChI:	InChI=1S/C8H19BO2/c1-2-3-4-5-6-7-8-9(10)11/h10-11H,2-8H2,1H3
InChI Key:	GKFRVXOKPXCXAK-UHFFFAOYSA-N
Boiling Point:	262.6 °C at 760 mmHg
Density:	0.89 g/cm³
MDL:	MFCD01074560
LogP:	1.81970

Publication Number	Title	Priority Date
WO-2021182557-A1	Polarizing film and method for manufacturing same	20200313
WO-2021123307-A2	Polypeptides having proteolytic activity and use thereof	20191220
WO-2021115912-A1	Formulations comprising a hydrophobically modified polyethyleneimine and one or more enzymes	20191209
WO-2021074430-A1	Storage-stable hydrolase containing liquids	20191018
WO-2021071932-A1	Antimicrobial and antiviral effects of c2-c7alkyl boronic acids	20191007

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	76.5
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	158.1478100
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	158.1478100
Rotatable Bond Count:	7
Topological Polar Surface Area:	40.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0