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201862-86-4 | Benzene, (4-iodo-3-cyclohexen-1-yl)-
CAS No: 201862-86-4 Catalog No: AG0027WB MDL No:
Product Description
Catalog Number:
AG0027WB
Chemical Name:
Benzene, (4-iodo-3-cyclohexen-1-yl)-
CAS Number:
201862-86-4
Molecular Formula:
C12H13I
Molecular Weight:
284.1361
IUPAC Name:
(4-iodocyclohex-3-en-1-yl)benzene
InChI:
InChI=1S/C12H13I/c13-12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-5,8,11H,6-7,9H2
InChI Key:
SFQLQFDUXWUFGG-UHFFFAOYSA-N
SMILES:
IC1=CCC(CC1)c1ccccc1
Properties
Complexity:
189
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.006g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
284.14g/mol
Monoisotopic Mass:
284.006g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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