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648933-52-2 | Naphthalene, 1-ethyl-3-iodo-
CAS No: 648933-52-2 Catalog No: AG00H8VN MDL No:
Product Description
Catalog Number:
AG00H8VN
Chemical Name:
Naphthalene, 1-ethyl-3-iodo-
CAS Number:
648933-52-2
Molecular Formula:
C12H11I
Molecular Weight:
282.1202
IUPAC Name:
1-ethyl-3-iodonaphthalene
InChI:
InChI=1S/C12H11I/c1-2-9-7-11(13)8-10-5-3-4-6-12(9)10/h3-8H,2H2,1H3
InChI Key:
KZPNLUZOGUCXPR-UHFFFAOYSA-N
SMILES:
CCc1cc(I)cc2c1cccc2
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.991g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
282.124g/mol
Monoisotopic Mass:
281.991g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
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