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143183-17-9 | Benzaldehyde, 4-[(methyloctadecylamino)methyl]-
CAS No: 143183-17-9 Catalog No: AG006WL1 MDL No:
Product Description
Catalog Number:
AG006WL1
Chemical Name:
Benzaldehyde, 4-[(methyloctadecylamino)methyl]-
CAS Number:
143183-17-9
Molecular Formula:
C27H47NO
Molecular Weight:
401.6682
IUPAC Name:
4-[[methyl(octadecyl)amino]methyl]benzaldehyde
InChI:
InChI=1S/C27H47NO/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-28(2)24-26-19-21-27(25-29)22-20-26/h19-22,25H,3-18,23-24H2,1-2H3
InChI Key:
KSEZHLYGKRTQAQ-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCCCN(Cc1ccc(cc1)C=O)C
Properties
Complexity:
348
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
401.366g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
401.679g/mol
Monoisotopic Mass:
401.366g/mol
Rotatable Bond Count:
20
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
10.1
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