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1396967-82-0 | AHTN-d3 100 µg/mL in Isooctane
CAS No: 1396967-82-0 Catalog No: AG01FO25 MDL No:
Product Description
Catalog Number:
AG01FO25
Chemical Name:
AHTN-d3 100 µg/mL in Isooctane
CAS Number:
1396967-82-0
IUPAC Name:
2,2,2-trideuterio-1-(3,5,5,6,8,8-hexamethyl-6,7-dihydronaphthalen-2-yl)ethanone
InChI:
InChI=1S/C18H26O/c1-11-8-16-15(9-14(11)13(3)19)17(4,5)10-12(2)18(16,6)7/h8-9,12H,10H2,1-7H3/i3D3
InChI Key:
DNRJTBAOUJJKDY-HPRDVNIFSA-N
Properties
Complexity:
366
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.217g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
3
Molecular Weight:
261.423g/mol
Monoisotopic Mass:
261.217g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
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