| CAS Number | 1052528-15-0 |
| Catalog Number | AG019HM7 |
| Chemical Name | Methyl 1h-benzimidazol-2-ylacetate hydrochloride |
| IUPAC Name | methyl 2-(1H-benzimidazol-2-yl)acetate;hydrochloride |
| InChI | InChI=1S/C10H10N2O2.ClH/c1-14-10(13)6-9-11-7-4-2-3-5-8(7)12-9;/h2-5H,6H2,1H3,(H,11,12);1H |
| InChI Key | WPVAFCYVAVDGAZ-UHFFFAOYSA-N |
| MDL Number | MFCD07279767 |
| Molecular Formula | C10H11ClN2O2 |
| Molecular Weight | 226.6595 |
| SMILES | Cl.COC(CC1NC2=C(C=CC=C2)N=1)=O |
| Synonyms | methyl 2-(1H-1,3-benzodiazol-2-yl)acetate hydrochloride,
1052528-15-0,
methyl 1H-benzimidazol-2-ylacetate hydrochloride,
methyl 2-(1H-benzo[d]imidazol-2-yl)acetate hydrochloride,
SMR000061401,
AC1O7FXF,
AC1Q3BXK,
MLS000048853,
CHEMBL1305412,
AKOS026676662,
MCULE-9477686991,
NE46359,
EN300-04000,
methyl 2-(1H-benzimidazol-2-yl)acetate hydrochloride,
Z56838494,
F2113-0026,
CID6603628,
49672-05-1,
|
| Complexity | 220 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 226.051g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 226.66g/mol |
| Monoisotopic Mass | 226.051g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 55A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number