| CAS Number | 110826-01-2 |
| Catalog Number | AG01B82R(AGN-PC-0P184V) |
| Chemical Name | (1R,2R)-2-(2-methoxyphenyl)cyclopropane-1-carboxylic acid |
| IUPAC Name | 2-(2-methoxyphenyl)cyclopropane-1-carboxylic acid |
| InChI | InChI=1S/C11H12O3/c1-14-10-5-3-2-4-7(10)8-6-9(8)11(12)13/h2-5,8-9H,6H2,1H3,(H,12,13) |
| InChI Key | QWTOSVJYKMLFEP-UHFFFAOYSA-N |
| MDL Number | MFCD20760172 |
| Molecular Formula | C11H12O3 |
| Molecular Weight | 192.2112 |
| SMILES | COC1=C(C=CC=C1)[C@H]1[C@@H](C1)C(=O)O |
| Synonyms | 92016-93-8,
2-(2-Methoxyphenyl)cyclopropanecarboxylic acid,
NE49197,
EN300-64844,
Cyclopropanecarboxylic acid, 2-(2-methoxyphenyl)-,
2-(2-METHOXY-PHENYL)-CYCLOPROPANECARBOXYLIC ACID,
Z1259161906,
C11H12O3,
(1R,2R)-2-(2-methoxyphenyl)cyclopropane-1-carboxylic acid,
2-(2-methoxyphenyl)cyclopropane-1-carboxylic acid,
110826-01-2,
AC1Q458C,
SCHEMBL1208921,
DTXSID30553514,
1056AJ,
AKOS009997127,
MCULE-8311275956,
|
| Complexity | 227 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 192.079g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 192.214g/mol |
| Monoisotopic Mass | 192.079g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 46.5A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number