5-Chloro-2-fluorophenylacetic Acid - CAS 261762-97-4

Catalog:	BB019171
Product Name:	5-Chloro-2-fluorophenylacetic Acid
CAS:	261762-97-4
Synonyms:	2-(5-chloro-2-fluorophenyl)acetic acid; 2-(5-chloro-2-fluorophenyl)acetic acid

Technical Data

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Patents

Computed Properties

IUPAC Name:	2-(5-chloro-2-fluorophenyl)acetic acid
Description:	5-Chloro-2-fluorophenylacetic Acid (CAS# 261762-97-4) is a useful research chemical.
Molecular Weight:	188.58
Molecular Formula:	C8H6ClFO2
Canonical SMILES:	C1=CC(=C(C=C1Cl)CC(=O)O)F
InChI:	InChI=1S/C8H6ClFO2/c9-6-1-2-7(10)5(3-6)4-8(11)12/h1-3H,4H2,(H,11,12)
InChI Key:	NOKLOLLCDCEFAK-UHFFFAOYSA-N
Appearance:	White crystalline
MDL:	MFCD01631439
LogP:	2.10620

Publication Number	Title	Priority Date
WO-2021170886-A2	Electronic device	20200806
WO-2020229968-A1	Non-lysosomal glucosylceramidase inhibitors and uses thereof	20190510
AU-2017260125-A1	Aromatic sulfonamide derivatives	20160503
AU-2017260125-A9	Aromatic sulfonamide derivatives	20160503
EP-3458443-A1	Aromatic sulfonamide derivatives	20160503

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Related Functional Groups

Carbonyl Compounds

[5650-34-0]
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[51493-02-8]
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[87-88-7]
Chloranilic acid
[1383427-98-2]
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[17746-05-3]
Undecanoyl chloride
[959574-98-2]
(3-Phenyl-1H-pyrazol-1-yl)acetic acid

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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:	174
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	188.0040353
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	188.0040353
Rotatable Bond Count:	2
Topological Polar Surface Area:	37.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.1