| CAS Number | 6226-33-1 |
| Catalog Number | AG01BFZK(AGN-PC-0WOS3L) |
| Chemical Name | 2-cyclopropylpropan-1-ol |
| IUPAC Name | 2-cyclopropylpropan-1-ol |
| InChI | InChI=1S/C6H12O/c1-5(4-7)6-2-3-6/h5-7H,2-4H2,1H3 |
| InChI Key | OVXXOYNXYWNSJE-UHFFFAOYSA-N |
| MDL Number | MFCD21324324 |
| Molecular Formula | C6H12O |
| Molecular Weight | 100.1589 |
| SMILES | CC(CO)C1CC1 |
| Synonyms | 2-cyclopropylpropan-1-ol,
6226-33-1,
2-Cyclopropyl-propanol-(1),
SCHEMBL140296,
AKOS015263184,
NE21274,
|
| Complexity | 57.2 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 100.089g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 7 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 100.161g/mol |
| Monoisotopic Mass | 100.089g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
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Certificate of Analysis
Lot Number