4-Iodo-N-methylbenzamide - CAS 89976-43-2
Catalog: |
BB060661 |
Product Name: |
4-Iodo-N-methylbenzamide |
CAS: |
89976-43-2 |
Synonyms: |
4-iodo-N-methylbenzamide; Benzamide, 4-iodo-N-methyl-; 4-Iodo N-methylbenzamide; N-Methyl-4-iodobenzamide; 4-iodo-N-methylbenzenamide; N-methyl-4-iodobenzoic acid amide |
IUPAC Name: | 4-iodo-N-methylbenzamide |
Description: | 4-Iodo-N-methylbenzamide |
Molecular Weight: | 261.06 |
Molecular Formula: | C8H8INO |
Canonical SMILES: | CNC(=O)C1=CC=C(C=C1)I |
InChI: | InChI=1S/C8H8INO/c1-10-8(11)6-2-4-7(9)5-3-6/h2-5H,1H3,(H,10,11) |
InChI Key: | MCWQNRJDIFEOIK-UHFFFAOYSA-N |
Complexity: | 141 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 260.96506 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 260.96506 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 29.1Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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