(3,4-dichloro-2-fluorophenyl)boronic acid - CAS 1160561-29-4

Catalog:	BB003699
Product Name:	(3,4-dichloro-2-fluorophenyl)boronic acid
CAS:	1160561-29-4
Synonyms:	(3,4-dichloro-2-fluorophenyl)boronic acid; (3,4-dichloro-2-fluorophenyl)boronic acid

Technical Data

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Computed Properties

IUPAC Name:	(3,4-dichloro-2-fluorophenyl)boronic acid
Description:	(3,4-dichloro-2-fluorophenyl)boronic acid (CAS# 1160561-29-4 ) is a useful research chemical.
Molecular Weight:	208.804
Molecular Formula:	C6H4BCl2FO2
Canonical SMILES:	B(C1=C(C(=C(C=C1)Cl)Cl)F)(O)O
InChI:	InChI=1S/C6H4BCl2FO2/c8-4-2-1-3(7(11)12)6(10)5(4)9/h1-2,11-12H
InChI Key:	VAGMFOMFJZBNKB-UHFFFAOYSA-N

Publication Number	Title	Priority Date
AU-2008256487-A1	Herbicidally active bicyclic 1,3-dione compounds	20070529
AU-2008256487-B2	Herbicidally active bicyclic 1,3-dione compounds	20070529
BR-PI0812027-B1	Compost, process for preparing a compost, method of controlling weed grasses in useful crop crops and herbicidal composition.	20070529
CA-2687202-A1	Herbicidally active bicyclic 1,3-dione compounds	20070529
CA-2687202-C	Herbicidally active bicyclic 1,3-dione compounds	20070529

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement:	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	161
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	207.9665431
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	207.9665431
Rotatable Bond Count:	1
Topological Polar Surface Area:	40.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0