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2351-50-0 | Benzene, 1-ethenyl-4-iodo-
CAS No: 2351-50-0 Catalog No: AG002NHQ MDL No:
Product Description
Catalog Number:
AG002NHQ
Chemical Name:
Benzene, 1-ethenyl-4-iodo-
CAS Number:
2351-50-0
Molecular Formula:
C8H7I
Molecular Weight:
230.0457
IUPAC Name:
1-ethenyl-4-iodobenzene
InChI:
InChI=1S/C8H7I/c1-2-7-3-5-8(9)6-4-7/h2-6H,1H2
InChI Key:
KWHSBYQFELZKKS-UHFFFAOYSA-N
SMILES:
C=Cc1ccc(cc1)I
Properties
Complexity:
90.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.959g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
230.048g/mol
Monoisotopic Mass:
229.959g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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