| CAS Number | 31462-57-4 |
| Catalog Number | AG00CL02(AGN-PC-01LTAD) |
| Chemical Name | 4-Iodopyrimidine |
| IUPAC Name | 4-iodopyrimidine |
| InChI | InChI=1S/C4H3IN2/c5-4-1-2-6-3-7-4/h1-3H |
| InChI Key | USYVBQLOSZDDBE-UHFFFAOYSA-N |
| MDL Number | MFCD16251620 |
| Molecular Formula | C4H3IN2 |
| Molecular Weight | 205.9845 |
| SMILES | c1cncnc1I |
| Synonyms | 4-iodopyrimidine,
31462-57-4,
4-iodo-pyrimidine,
6-iodo pyrimidine,
SCHEMBL171767,
DTXSID70590827,
9969AD,
MFCD16251620,
ZINC66327942,
AKOS015892438,
RP08195,
SB13069,
SC-51992,
FT-0685569,
I03-0542,
J-515581,
1-2 weeks,
C4H3IN2,
|
| Complexity | 57.7 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 205.934g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 7 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 205.986g/mol |
| Monoisotopic Mass | 205.934g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 25.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number