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114084-54-7 | Benzenemethanamine, N-hexadecyl-
CAS No: 114084-54-7 Catalog No: AG000AHZ MDL No:
Product Description
Catalog Number:
AG000AHZ
Chemical Name:
Benzenemethanamine, N-hexadecyl-
CAS Number:
114084-54-7
Molecular Formula:
C23H41N
Molecular Weight:
331.5783
IUPAC Name:
N-benzylhexadecan-1-amine
InChI:
InChI=1S/C23H41N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-21-24-22-23-19-16-15-17-20-23/h15-17,19-20,24H,2-14,18,21-22H2,1H3
InChI Key:
SZBUYNOTXPNWFG-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCNCc1ccccc1
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
331.324g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
331.588g/mol
Monoisotopic Mass:
331.324g/mol
Rotatable Bond Count:
17
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
9
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