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943115-82-0

943115-82-0 | 4-[(1-Homopiperidino)methyl]benzaldehyde

CAS No: 943115-82-0 Catalog No: AG01EZH5 MDL No:

Product Description

Catalog Number:
AG01EZH5
Chemical Name:
4-[(1-Homopiperidino)methyl]benzaldehyde
CAS Number:
943115-82-0
Molecular Formula:
C14H19NO
Molecular Weight:
217.3068
IUPAC Name:
4-(azepan-1-ylmethyl)benzaldehyde
InChI:
InChI=1S/C14H19NO/c16-12-14-7-5-13(6-8-14)11-15-9-3-1-2-4-10-15/h5-8,12H,1-4,9-11H2
InChI Key:
MRZCWWJOKSOOJQ-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)CN1CCCCCC1

Properties

Complexity:
201  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.147g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.312g/mol
Monoisotopic Mass:
217.147g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  

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