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87842-54-4 | Naphthalene, 1,2,3,4,4a,5,6,8a-octahydro-8-iodo-, trans-
CAS No: 87842-54-4 Catalog No: AG004JG6 MDL No:
Product Description
Catalog Number:
AG004JG6
Chemical Name:
Naphthalene, 1,2,3,4,4a,5,6,8a-octahydro-8-iodo-, trans-
CAS Number:
87842-54-4
Molecular Formula:
C10H15I
Molecular Weight:
262.1306
IUPAC Name:
(4aR,8aS)-8-iodo-1,2,3,4,4a,5,6,8a-octahydronaphthalene
InChI:
InChI=1S/C10H15I/c11-10-7-3-5-8-4-1-2-6-9(8)10/h7-9H,1-6H2/t8-,9+/m1/s1
InChI Key:
UBLAIIHKUVIPPP-BDAKNGLRSA-N
SMILES:
IC1=CCC[C@@H]2[C@@H]1CCCC2
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
262.022g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
262.134g/mol
Monoisotopic Mass:
262.022g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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