N-(4-Methoxybenzylidene)-4-fluoroaniline - CAS 3381-48-4

Name: N-(4-Methoxybenzylidene)-4-fluoroaniline
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB021844
Product Name:	N-(4-Methoxybenzylidene)-4-fluoroaniline
CAS:	3381-48-4
Synonyms:	N-(4-fluorophenyl)-1-(4-methoxyphenyl)methanimine

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	N-(4-fluorophenyl)-1-(4-methoxyphenyl)methanimine
Description:	N-(4-Methoxybenzylidene)-4-fluoroaniline (CAS# 3381-48-4 ) is a useful research chemical.
Molecular Weight:	229.25
Molecular Formula:	C14H12FNO
Canonical SMILES:	COC1=CC=C(C=C1)C=NC2=CC=C(C=C2)F
InChI:	InChI=1S/C14H12FNO/c1-17-14-8-2-11(3-9-14)10-16-13-6-4-12(15)5-7-13/h2-10H,1H3
InChI Key:	ZICFPEHQRZAFBZ-UHFFFAOYSA-N
Boiling Point:	349.7 °C at 760 mmHg
Density:	1.07 g/cm³
MDL:	MFCD00028099
LogP:	3.58490

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Related Functional Groups

Fluorinated Building Blocks

[452-76-6]C7H6F2
2,4-Difluorotoluene
[1170836-29-9]C12H12F3N5
3-(1',3'-Dimethyl-5-(trifluoromethyl)-1'H,2H-[3,4'-bipyrazol]-2-yl)propanenitrile
[459836-92-1]C8H6F2O2
3,6-Difluoro-2-methylbenzoic acid
[2091593-59-6]C9H10F3NO
3-methoxy-6-methyl-2-(trifluoromethyl)aniline
[927800-47-3]C10H4Cl4FN
4-Chloro-6-fluoro-2-trichloromethyl-quinoline
[861225-50-5]C11H9ClF2O3
4-Chloro-4,4-difluoro-1-(4-methoxyphenyl)butane-1,3-dione

Nitrogen Compounds

[1427004-19-0]C34H39N3O10
DBCO-PEG4-NHS ester
[1281984-38-0]C8H10N4O4
1-Cyclopentyl-3,5-dinitro-1H-pyrazole
[1170836-25-5]C8H11N3O2
1-Cyclopentyl-5-nitro-1H-pyrazole
[916792-07-9]C8H5BrFN
2-Bromo-4-fluoro-5-methylbenzonitrile
[1170836-29-9]C12H12F3N5
3-(1',3'-Dimethyl-5-(trifluoromethyl)-1'H,2H-[3,4'-bipyrazol]-2-yl)propanenitrile
[158387-00-9]C9H11N3O
3-Oxo-3-(1,3,5-trimethyl-1H-pyrazol-4-yl)propanenitrile

Other Pyrimidines

[1183749-69-0]C10H8N2O2
2-(pyrimidin-2-yloxy)phenol
[452-76-6]C7H6F2
2,4-Difluorotoluene
[937601-34-8]C9H8BrN3O2
3-Bromo-2,5-dimethylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid
[351-28-0]C8H8FNO
3'-Fluoroacetanilide
[1632145-37-9]0
3-Methyl-3-(perfluoropyridin-4-yl)-1,5-dioxaspiro[5.5]undecane-2,4-dione
[451-46-7]C9H9FO2
Ethyl 4-fluorobenzoate

GHS Hazard Statement:	H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]
Precautionary Statement:	P280, P305+P351+P338, and P310
Signal Word:	Danger

Publication Number	Title	Priority Date
US-2011046389-A1	Intermediates for the preparation of (3r, 4s)-1-(4-fluorophenyl)-3-[(3s)-3-(4-fluorophenyl)-3-hydroxypropyl)]-4-(4-hydroxyphenyl)-2-azetidinone	20080225
WO-2008104875-A1	Oxazolidinones as cholesterol absorption inhibitors	20070301
US-2008214547-A1	Methods and compositions of trail-death receptor agonists/activators	20070201
US-2011172234-A1	Methods and compositions of trail-death receptor agonists/activators	20070201
US-7915245-B2	Methods and compositions of trail-death receptor agonists/activators	20070201

Complexity:	241
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	229.090292168
Formal Charge:	0
Heavy Atom Count:	17
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	229.090292168
Rotatable Bond Count:	3
Topological Polar Surface Area:	21.6 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.3