| CAS Number | 76041-87-7 |
| Catalog Number | AG00ICOW(AGN-PC-0OHQXU) |
| Chemical Name | N,N-Diethyl-2-iodobenzamide |
| IUPAC Name | N,N-diethyl-2-iodobenzamide |
| InChI | InChI=1S/C11H14INO/c1-3-13(4-2)11(14)9-7-5-6-8-10(9)12/h5-8H,3-4H2,1-2H3 |
| InChI Key | BYACPVJFVPBGQI-UHFFFAOYSA-N |
| MDL Number | MFCD01191133 |
| Molecular Formula | C11H14INO |
| Molecular Weight | 303.1394 |
| SMILES | C(C)N(C(C1=C(C=CC=C1)I)=O)CC |
| Synonyms | N,N-diethyl-2-iodobenzamide,
76041-87-7,
2-Iodo-N,N-diethylbenzamide,
AC1LG53G,
SCHEMBL10488519,
Benzamide, N,N-diethyl-2-iodo-,
BYACPVJFVPBGQI-UHFFFAOYSA-N,
ZINC288520,
N,N-diethyl(2-iodophenyl)carboxamide,
AKOS003235448,
MCULE-9032586199,
ST50686299,
SR-01000216010,
SR-01000216010-1,
CID789049,
ZINC00288520,
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| Complexity | 192 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 303.012g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 303.143g/mol |
| Monoisotopic Mass | 303.012g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 20.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number