| CAS Number | 1286777-19-2 |
| Catalog Number | AG01B9SH |
| Chemical Name | 5-(Cyclopropylmethoxy)pyrazine-2-carboxylic acid |
| IUPAC Name | 5-(cyclopropylmethoxy)pyrazine-2-carboxylic acid |
| InChI | InChI=1S/C9H10N2O3/c12-9(13)7-3-11-8(4-10-7)14-5-6-1-2-6/h3-4,6H,1-2,5H2,(H,12,13) |
| InChI Key | UTKCEOFCDHLKRM-UHFFFAOYSA-N |
| MDL Number | MFCD20284638 |
| Molecular Formula | C9H10N2O3 |
| Molecular Weight | 194.1873 |
| SMILES | OC(C1=NC=C(OCC2CC2)N=C1)=O |
| Synonyms | 1286777-19-2,
5-(cyclopropylmethoxy)pyrazine-2-carboxylic acid,
SCHEMBL1975057,
UTKCEOFCDHLKRM-UHFFFAOYSA-N,
ZINC70582549,
AKOS013585991,
KS-9231,
FT-0763194,
5-cyclopropylmethoxy-pyrazine-2-carboxylic acid,
2-Pyrazinecarboxylicacid,5-(cyclopropylmethoxy)-,
2-Pyrazinecarboxylic acid, 5-(cyclopropylmethoxy)-,
Z2037266903,
5-(cyclopropylmethoxy)-2-Pyrazinecarboxylic acid,
|
| Complexity | 218 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 194.069g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 194.19g/mol |
| Monoisotopic Mass | 194.069g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 72.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number