4-Fluorophenylacetyl chloride - CAS 459-04-1

Catalog:	BB026010
Product Name:	4-Fluorophenylacetyl chloride
CAS:	459-04-1
Synonyms:	2-(4-fluorophenyl)acetyl chloride

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	2-(4-fluorophenyl)acetyl chloride
Description:	4-Fluorophenylacetyl chloride (CAS# 459-04-1) is a useful research chemical.
Molecular Weight:	172.58
Molecular Formula:	C8H6ClFO
Canonical SMILES:	C1=CC(=CC=C1CC(=O)Cl)F
InChI:	InChI=1S/C8H6ClFO/c9-8(11)5-6-1-3-7(10)4-2-6/h1-4H,5H2
InChI Key:	SIOJFYRPBYGHOO-UHFFFAOYSA-N
Boiling Point:	60 °C (8 torr)
Melting Point:	47-48 °C
Purity:	98 %
Density:	1.259 g/cm³
Appearance:	Clear yellow liquid.
Storage:	Store at RT.
MDL:	MFCD00674181
LogP:	2.13360

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Related Functional Groups

Carbonyl Compounds

[1383427-98-2]
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[1035840-45-9]
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[59855-96-8]
2-(Methoxymethyl)thiazole-5-carboxylic Acid
[1016519-61-1]
2-(Methyl-2-pyridylamino)acetic Acid
[108397-75-7]
2,4,6-Trimethylpyrimidine-5-carboxylic Acid
[4313-03-5]
2,4-Heptadienal

Fluorinated Building Blocks

[1946823-77-3]
[1,4-Dimethyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]methanol
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[865774-78-3]
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
[1170836-29-9]
3-(1',3'-Dimethyl-5-(trifluoromethyl)-1'H,2H-[3,4'-bipyrazol]-2-yl)propanenitrile
[150517-77-4]
3-Fluoro-5-(trifluoromethyl)benzylamine
[927800-47-3]
4-Chloro-6-fluoro-2-trichloromethyl-quinoline

Other Pyrimidines

[1183749-69-0]
2-(pyrimidin-2-yloxy)phenol
[451-46-7]
Ethyl 4-fluorobenzoate
[860790-29-0]
N-[4-Cyclopropyl-6-(trifluoromethyl)pyrimidin-2-yl]propane-1,3-diamine
[1192570-20-9]
2-Morpholino-2-(2-(trifluoromethyl)pyrimidin-5-yl)ethanamine
[932236-53-8]
3-(4-Chlorophenyl)pyrazolo[1,5-a]pyrimidin-6-amine
[113583-35-0]
4,6-Dimethoxy-2-(methylsulfonyl)pyrimidine

GHS Hazard Statement:	H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
Precautionary Statement:	P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501
Signal Word:	Danger

Complexity:	141
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	172.0091207
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	172.0091207
Rotatable Bond Count:	2
Topological Polar Surface Area:	17.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.5