| CAS Number | 710314-32-2 |
| Catalog Number | AG01B7U1 |
| Chemical Name | Bicyclo[4.1.0]heptane-3-carboxylic Acid |
| IUPAC Name | bicyclo[4.1.0]heptane-3-carboxylic acid |
| InChI | InChI=1S/C8H12O2/c9-8(10)6-2-1-5-3-7(5)4-6/h5-7H,1-4H2,(H,9,10) |
| InChI Key | WFRDCXXZMJFGCL-UHFFFAOYSA-N |
| MDL Number | MFCD24499269 |
| Molecular Formula | C8H12O2 |
| Molecular Weight | 140.1797 |
| SMILES | OC(C1CC2C(C2)CC1)=O |
| Synonyms | Bicyclo[4.1.0]heptane-3-carboxylic acid,
710314-32-2,
SCHEMBL1423781,
WFRDCXXZMJFGCL-UHFFFAOYSA-N,
AKOS023200898,
Z2350907389,
|
| Complexity | 165 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 140.084g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 140.182g/mol |
| Monoisotopic Mass | 140.084g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 37.3A^2 |
| Undefined Atom Stereocenter Count | 3 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
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Certificate of Analysis
Lot Number