| CAS Number | 113948-07-5 |
| Catalog Number | AG00HCRB(AGN-PC-0JXEY1) |
| Chemical Name | N-Ethyl-4-iodobenzamide |
| IUPAC Name | N-ethyl-4-iodobenzamide |
| InChI | InChI=1S/C9H10INO/c1-2-11-9(12)7-3-5-8(10)6-4-7/h3-6H,2H2,1H3,(H,11,12) |
| InChI Key | GWPYHDFCCRYKCZ-UHFFFAOYSA-N |
| MDL Number | MFCD03703872 |
| Molecular Formula | C9H10INO |
| Molecular Weight | 275.0863 |
| SMILES | CCNC(C1=CC=C(I)C=C1)=O |
| Synonyms | N-ethyl-4-iodobenzamide,
113948-07-5,
AC1LGRQ1,
Benzamide, N-ethyl-4-iodo-,
SCHEMBL7715145,
GWPYHDFCCRYKCZ-UHFFFAOYSA-N,
ZINC444134,
STK225354,
AKOS003341249,
MCULE-3932566264,
NE51412,
DA-47789,
FT-0735299,
EN300-81748,
SR-01000230448,
SR-01000230448-1,
CID875746,
ZINC00444134,
|
| Complexity | 153 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 274.981g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 275.089g/mol |
| Monoisotopic Mass | 274.981g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number