| CAS Number | 5199-50-8 |
| Catalog Number | AG00VV7I(AGN-PC-0LTF6F) |
| Chemical Name | Methyl 2-iodoacetate |
| IUPAC Name | methyl 2-iodoacetate |
| InChI | InChI=1S/C3H5IO2/c1-6-3(5)2-4/h2H2,1H3 |
| InChI Key | YDGMIJCIBXSCQR-UHFFFAOYSA-N |
| MDL Number | MFCD20484033 |
| Molecular Formula | C3H5IO2 |
| Molecular Weight | 199.9751 |
| SMILES | O=C(OC)CI |
| Synonyms | methyl 2-iodoacetate,
Methyl iodoacetate,
5199-50-8,
Iodoacetic acid methyl ester,
Acetic acid, iodo-, methyl ester,
YDGMIJCIBXSCQR-UHFFFAOYSA-N,
Methyl-2-iodoacetate,
AC1O58FP,
SCHEMBL17390,
CTK1G3624,
DTXSID30423925,
ZINC14556339,
AKOS016353049,
MCULE-9545584156,
Methyl 2-?iodoacetate - stabilized over Cu,
CID6429536,
|
| Complexity | 52.8 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 199.933g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 6 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 199.975g/mol |
| Monoisotopic Mass | 199.933g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 26.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number