2-Iodophenyl Isocyanide - CAS 183209-25-8
Catalog: |
BB072904 |
Product Name: |
2-Iodophenyl Isocyanide |
CAS: |
183209-25-8 |
Synonyms: |
1-iodo-2-isocyanobenzene; 2-iodophenyl isocyanide |
IUPAC Name: | 1-iodo-2-isocyanobenzene |
Molecular Weight: | 229.01 |
Molecular Formula: | C7H4NI |
Canonical SMILES: | [C-]#[N+]C1=CC=CC=C1I |
InChI: | InChI=1S/C7H4IN/c1-9-7-5-3-2-4-6(7)8/h2-5H |
InChI Key: | LRVUESGQPSOZCA-UHFFFAOYSA-N |
Complexity: | 135 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 228.93885 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 228.93885 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 4.4Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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