4-Fluorophenylacetaldehyde dimethylacetal - CAS 121039-98-3

Catalog:	BB005023
Product Name:	4-Fluorophenylacetaldehyde dimethylacetal
CAS:	121039-98-3
Synonyms:	1-(2,2-dimethoxyethyl)-4-fluorobenzene

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	1-(2,2-dimethoxyethyl)-4-fluorobenzene
Description:	4-Fluorophenylacetaldehyde dimethylacetal (CAS# 121039-98-3) is a useful research chemical.
Molecular Weight:	184.21
Molecular Formula:	C10H13FO2
Canonical SMILES:	COC(CC1=CC=C(C=C1)F)OC
InChI:	InChI=1S/C10H13FO2/c1-12-10(13-2)7-8-3-5-9(11)6-4-8/h3-6,10H,7H2,1-2H3
InChI Key:	ICDKNFHCKJLHMN-UHFFFAOYSA-N
LogP:	1.98710

Publication Number	Title	Priority Date
DE-4234766-A1	Process for the isolation or purification of aryl-acetaldehyde acetals	19921015
DE-4234766-C2	Process for the isolation or purification of aryl acetaldehyde acetals	19921015
JP-H06211721-A	Method for purifying 2-arylacetaldehyde acetal	19921015
DE-4220939-A1	Process for the preparation of 2-aryl-ethanols	19920626
JP-3447325-B2	Method for producing 2-aryl-ethanol	19920626

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Related Functional Groups

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Oxygen Compounds

[134769-80-5]
3-Methylphenylacetaldehyde dimethyl acetal
[5896-75-3]
(Z)-N-(4-Phenylpiperazin-1-yl)-1-(2,3,4-trimethoxyphenyl)methanimine
[1263034-11-2]
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[1006443-01-1]
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[865774-78-3]
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[1183749-69-0]
2-(pyrimidin-2-yloxy)phenol

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:	129
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	184.08995782
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	184.08995782
Rotatable Bond Count:	4
Topological Polar Surface Area:	18.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.2