N-Ethyl-3-iodobenzamide - CAS 113948-06-4
Catalog: |
BB066106 |
Product Name: |
N-Ethyl-3-iodobenzamide |
CAS: |
113948-06-4 |
Synonyms: |
N-ethyl-3-iodobenzamide; Benzamide, N-ethyl-3-iodo- |
IUPAC Name: | N-ethyl-3-iodobenzamide |
Description: | N-Ethyl-3-iodobenzamide |
Molecular Weight: | 275.09 |
Molecular Formula: | C9H10INO |
Canonical SMILES: | CCNC(=O)C1=CC(=CC=C1)I |
InChI: | InChI=1S/C9H10INO/c1-2-11-9(12)7-4-3-5-8(10)6-7/h3-6H,2H2,1H3,(H,11,12) |
InChI Key: | DLJHACZHZRBDJF-UHFFFAOYSA-N |
Complexity: | 161 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 274.98071 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 274.98071 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 29.1Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.2 |
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