| CAS Number | 1243374-60-8 |
| Catalog Number | AG01BB3Q |
| Chemical Name | 2-Cyclopropoxybenzoic acid |
| IUPAC Name | 2-cyclopropyloxybenzoic acid |
| InChI | InChI=1S/C10H10O3/c11-10(12)8-3-1-2-4-9(8)13-7-5-6-7/h1-4,7H,5-6H2,(H,11,12) |
| InChI Key | HJBBRHYDVCVOEF-UHFFFAOYSA-N |
| MDL Number | MFCD17000472 |
| Molecular Formula | C10H10O3 |
| Molecular Weight | 178.1846 |
| SMILES | O=C(O)C1=CC=CC=C1OC2CC2 |
| Synonyms | 2-CYCLOPROPOXYBENZOIC ACID,
1243374-60-8,
2-(cyclopropyloxy)Benzoic acid,
2-Cyclopropoxy-benzoic acid-,
SCHEMBL20561976,
ZINC95713522,
AKOS023798241,
MB26448,
DA-13773,
FT-0756343,
Z2096087472,
|
| Complexity | 198 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 178.063g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 178.187g/mol |
| Monoisotopic Mass | 178.063g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 46.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number