| CAS Number | 1427367-66-5 |
| Catalog Number | AG009WJF(AGN-PC-0WAH66) |
| Chemical Name | 5-(chloromethyl)-2-methylpyrimidine hydrochloride |
| IUPAC Name | 5-(chloromethyl)-2-methylpyrimidine;hydrochloride |
| InChI | InChI=1S/C6H7ClN2.ClH/c1-5-8-3-6(2-7)4-9-5;/h3-4H,2H2,1H3;1H |
| InChI Key | YMCHHDMKAXRBFM-UHFFFAOYSA-N |
| MDL Number | MFCD22570247 |
| Molecular Formula | C6H8Cl2N2 |
| Molecular Weight | 179.0471 |
| SMILES | CC1=NC=C(CCl)C=N1.[H]Cl |
| Synonyms | 5-(Chloromethyl)-2-methylpyrimidine hydrochloride,
1427367-66-5,
5-(Chloromethyl)-2-methylpyrimidine HCl,
MFCD22570247,
AKOS022188378,
SB20226,
AS-53119,
CS-0050759,
KS-00000723,
5-(Chloromethyl)-2-methylpyrimidine?hydrochloride,
1337879-54-5,
|
| Complexity | 79.1 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 178.006g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 179.044g/mol |
| Monoisotopic Mass | 178.006g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 25.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
|
Hazard Class
|
|
|
Hazard statements
|
H302-H315-H319-H335
|
|
Packing Group
|
|
|
Precautionary statements
|
P261-P305+P351+P338
|
|
UN Code
|
|
Certificate of Analysis
Lot Number