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Home > Aldehydes > 174213-15-1
174213-15-1 | 3-[(1-Homopiperidino)methyl]benzaldehyde
CAS No: 174213-15-1 Catalog No: AG01FC3U MDL No:
Product Description
Catalog Number:
AG01FC3U
Chemical Name:
3-[(1-Homopiperidino)methyl]benzaldehyde
CAS Number:
174213-15-1
Molecular Formula:
C14H19NO
Molecular Weight:
217.3068
IUPAC Name:
3-(azepan-1-ylmethyl)benzaldehyde
InChI:
InChI=1S/C14H19NO/c16-12-14-7-5-6-13(10-14)11-15-8-3-1-2-4-9-15/h5-7,10,12H,1-4,8-9,11H2
InChI Key:
OEKCHUXGLYFJOL-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1)CN1CCCCCC1
Properties
Complexity:
209
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:
3
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