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1443355-38-1

1443355-38-1 | 3-Fluoro-4-[(1-homopiperidino)methyl]benzaldehyde

CAS No: 1443355-38-1 Catalog No: AG01F9CQ MDL No:

Product Description

Catalog Number:
AG01F9CQ
Chemical Name:
3-Fluoro-4-[(1-homopiperidino)methyl]benzaldehyde
CAS Number:
1443355-38-1
Molecular Formula:
C14H18FNO
Molecular Weight:
235.2972
IUPAC Name:
4-(azepan-1-ylmethyl)-3-fluorobenzaldehyde
InChI:
InChI=1S/C14H18FNO/c15-14-9-12(11-17)5-6-13(14)10-16-7-3-1-2-4-8-16/h5-6,9,11H,1-4,7-8,10H2
InChI Key:
GXOILHHMFKWKCT-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(c(c1)F)CN1CCCCCC1

Properties

Complexity:
238  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.137g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
235.302g/mol
Monoisotopic Mass:
235.137g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  

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