2-Fluoro-4-nitrophenylacetic Acid - CAS 315228-19-4

Catalog:	BB020960
Product Name:	2-Fluoro-4-nitrophenylacetic Acid
CAS:	315228-19-4
Synonyms:	2-(2-fluoro-4-nitrophenyl)acetic acid; 2-(2-fluoro-4-nitrophenyl)acetic acid

Technical Data

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Computed Properties

IUPAC Name:	2-(2-fluoro-4-nitrophenyl)acetic acid
Description:	2-Fluoro-4-nitrophenylacetic Acid (CAS# 315228-19-4) is a useful research chemical.
Molecular Weight:	199.14
Molecular Formula:	C8H6FNO4
Canonical SMILES:	C1=CC(=C(C=C1[N+](=O)[O-])F)CC(=O)O
InChI:	InChI=1S/C8H6FNO4/c9-7-4-6(10(13)14)2-1-5(7)3-8(11)12/h1-2,4H,3H2,(H,11,12)
InChI Key:	HKGNZXXYXCKJHO-UHFFFAOYSA-N
MDL:	MFCD11041422
LogP:	1.88420

Publication Number	Title	Priority Date
CN-113248471-A	Preparation method of zolamide drug intermediate and intermediate thereof	20210705
CN-113248471-B	Preparation method of zolamide drug intermediate and intermediate thereof	20210705
CN-111377907-A	Polysubstituted phenylamino pyrimidine derivative and preparation method and application thereof	20181226
WO-2020135507-A1	Polysubstituted anilinopyrimidine derivative and preparation method and application thereof	20181226
WO-2019213470-A1	Benzimidazole derivatives as modulators of retinoid-related orphan receptor gamma (rorÏ') and pharmaceutical uses thereof	20180503

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Related Functional Groups

Carbonyl Compounds

[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[1427004-19-0]
DBCO-PEG4-NHS ester
[1006443-01-1]
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[957292-12-5]
2-(3-Cyclopropyl-1H-pyrazol-1-yl)acetic acid
[2168559-63-3]
2-(6-Methyl-2-pyridyl)acetic Acid Hydrochloride
[17432-37-0]
2,3,5,6-Tetramethylbenzaldehyde

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	240
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	199.02808583
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	199.02808583
Rotatable Bond Count:	2
Topological Polar Surface Area:	83.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.3