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144191-55-9 | Acridinium, 10-hexadecyl-, bromide (1:1)
CAS No: 144191-55-9 Catalog No: AG001J3F MDL No:
Product Description
Catalog Number:
AG001J3F
Chemical Name:
Acridinium, 10-hexadecyl-, bromide (1:1)
CAS Number:
144191-55-9
Molecular Formula:
C29H42BrN
Molecular Weight:
484.5545
IUPAC Name:
10-hexadecylacridin-10-ium;bromide
InChI:
InChI=1S/C29H42N.BrH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-19-24-30-28-22-17-15-20-26(28)25-27-21-16-18-23-29(27)30;/h15-18,20-23,25H,2-14,19,24H2,1H3;1H/q+1;/p-1
InChI Key:
WWRYAHAKRWNCJQ-UHFFFAOYSA-M
SMILES:
CCCCCCCCCCCCCCCC[n+]1c2ccccc2cc2c1cccc2.[Br-]
Properties
Complexity:
397
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
483.25g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
484.566g/mol
Monoisotopic Mass:
483.25g/mol
Rotatable Bond Count:
15
Topological Polar Surface Area:
3.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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