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2D Structure
Also known as: 3381-48-4, N-(4-fluorophenyl)-1-(4-methoxyphenyl)methanimine, Schembl2904627, Zinc96460, Dtxsid10351732, Stk070800
Molecular Formula
C14H12FNO
Molecular Weight
229.25  g/mol
InChI Key
ZICFPEHQRZAFBZ-UHFFFAOYSA-N

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
N-(4-fluorophenyl)-1-(4-methoxyphenyl)methanimine
2.1.2 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
2.1.3 InChI Key
ZICFPEHQRZAFBZ-UHFFFAOYSA-N
2.1.4 Canonical SMILES
COC1=CC=C(C=C1)C=NC2=CC=C(C=C2)F
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 3381-48-4

2. N-(4-fluorophenyl)-1-(4-methoxyphenyl)methanimine

3. Schembl2904627

4. Zinc96460

5. Dtxsid10351732

6. Stk070800

7. Akos000344077

8. 4-fluorophenyl(4-methoxybenzylidene)-amine

9. N-(4-methoxybenzylidene)-4-fluoroaniline, 97%

10. J-019330

11. 4-fluoro-n-[(e)-(4-methoxyphenyl)methylidene]aniline

2.3 Create Date
2005-07-08
3 Chemical and Physical Properties
Molecular Weight 229.25 g/mol
Molecular Formula C14H12FNO
XLogP33.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass229.090292168 g/mol
Monoisotopic Mass229.090292168 g/mol
Topological Polar Surface Area21.6 Ų
Heavy Atom Count17
Formal Charge0
Complexity241
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1