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1199782-87-0 | 1(2H)-Naphthalenone, 3,4-dihydro-5-iodo-
CAS No: 1199782-87-0 Catalog No: AG000PXT MDL No:MFCD09751532
Product Description
Catalog Number:
AG000PXT
Chemical Name:
1(2H)-Naphthalenone, 3,4-dihydro-5-iodo-
CAS Number:
1199782-87-0
Molecular Formula:
C10H9IO
Molecular Weight:
272.0823
MDL Number:
MFCD09751532
IUPAC Name:
5-iodo-3,4-dihydro-2H-naphthalen-1-one
InChI:
InChI=1S/C10H9IO/c11-9-5-1-4-8-7(9)3-2-6-10(8)12/h1,4-5H,2-3,6H2
InChI Key:
KFSAKKGZKAQYEI-UHFFFAOYSA-N
SMILES:
O=C1CCCc2c1cccc2I
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.97g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
272.085g/mol
Monoisotopic Mass:
271.97g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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