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1443340-55-3 | 2-[(Di-n-butylamino)methyl]benzaldehyde
CAS No: 1443340-55-3 Catalog No: AG01FCEH MDL No:
Product Description
Catalog Number:
AG01FCEH
Chemical Name:
2-[(Di-n-butylamino)methyl]benzaldehyde
CAS Number:
1443340-55-3
Molecular Formula:
C16H25NO
Molecular Weight:
247.3758
IUPAC Name:
2-[(dibutylamino)methyl]benzaldehyde
InChI:
InChI=1S/C16H25NO/c1-3-5-11-17(12-6-4-2)13-15-9-7-8-10-16(15)14-18/h7-10,14H,3-6,11-13H2,1-2H3
InChI Key:
QCCVOBNLJHSCRN-UHFFFAOYSA-N
SMILES:
CCCCN(Cc1ccccc1C=O)CCCC
Properties
Complexity:
209
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.194g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.382g/mol
Monoisotopic Mass:
247.194g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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