3'-Fluoro-2'-hydroxyacetophenone - CAS 699-92-3

Catalog:	BB034040
Product Name:	3'-Fluoro-2'-hydroxyacetophenone
CAS:	699-92-3
Synonyms:	1-(3-fluoro-2-hydroxyphenyl)ethanone; 1-(3-fluoro-2-hydroxyphenyl)ethanone

Technical Data

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Computed Properties

IUPAC Name:	1-(3-fluoro-2-hydroxyphenyl)ethanone
Description:	3'-Fluoro-2'-hydroxyacetophenone (CAS# 699-92-3) is a useful research chemical.
Molecular Weight:	154.14
Molecular Formula:	C8H7FO2
Canonical SMILES:	CC(=O)C1=C(C(=CC=C1)F)O
InChI:	InChI=1S/C8H7FO2/c1-5(10)6-3-2-4-7(9)8(6)11/h2-4,11H,1H3
InChI Key:	WXTHZWWWCICGAN-UHFFFAOYSA-N
Boiling Point:	209.004 °C at 760 mmHg
Density:	1.247 g/cm³
MDL:	MFCD09055140
LogP:	1.73390

Publication Number	Title	Priority Date
WO-2021047674-A1	Bicyclic compound that acts as crbn protein regulator	20190912
WO-2020132603-A2	Salicyl-adenosinemonosulfamate analogs and uses thereof	20181221
WO-2019062802-A1	ISOXAZOLINE DERIVATIVES AND USES THEREOF IN AN AGRICULTURAL APPLICATION	20170928
CN-109574945-B	Isoxazoline derivatives and their use in agriculture	20170928
CA-2965981-A1	Substituted chromanes and method of use	20141031

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Related Functional Groups

Carbonyl Compounds

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GHS Hazard Statement:	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, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	158
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	154.04300762
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	154.04300762
Rotatable Bond Count:	1
Topological Polar Surface Area:	37.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.9