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78524-69-3 | Piperidinium,1-[(hexadecyloxy)methyl]-1-methyl-, chloride (1:1)
CAS No: 78524-69-3 Catalog No: AG00537G MDL No:
Product Description
Catalog Number:
AG00537G
Chemical Name:
Piperidinium,1-[(hexadecyloxy)methyl]-1-methyl-, chloride (1:1)
CAS Number:
78524-69-3
Molecular Formula:
C23H48ClNO
Molecular Weight:
390.0863
IUPAC Name:
1-(hexadecoxymethyl)-1-methylpiperidin-1-ium;chloride
InChI:
InChI=1S/C23H48NO.ClH/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-25-23-24(2)20-17-16-18-21-24;/h3-23H2,1-2H3;1H/q+1;/p-1
InChI Key:
LQXQSLZWBNJERD-UHFFFAOYSA-M
SMILES:
CCCCCCCCCCCCCCCCOC[N+]1(C)CCCCC1.[Cl-]
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
389.342g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
390.093g/mol
Monoisotopic Mass:
389.342g/mol
Rotatable Bond Count:
17
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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