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65886-93-3 | Bicyclo[4.2.0]octa-1,3,5-triene, 2-iodo-3-(iodomethyl)-
CAS No: 65886-93-3 Catalog No: AG006MOJ MDL No:
Product Description
Catalog Number:
AG006MOJ
Chemical Name:
Bicyclo[4.2.0]octa-1,3,5-triene, 2-iodo-3-(iodomethyl)-
CAS Number:
65886-93-3
Molecular Formula:
C9H8I2
Molecular Weight:
369.9688
IUPAC Name:
2-iodo-3-(iodomethyl)bicyclo[4.2.0]octa-1(6),2,4-triene
InChI:
InChI=1S/C9H8I2/c10-5-7-2-1-6-3-4-8(6)9(7)11/h1-2H,3-5H2
InChI Key:
UIFCJJJUQSXTEU-UHFFFAOYSA-N
SMILES:
ICc1ccc2c(c1I)CC2
Properties
Complexity:
147
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
369.872g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
369.972g/mol
Monoisotopic Mass:
369.872g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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