| CAS Number | 177200-76-9 |
| Catalog Number | AG00ADD4(AGN-PC-0WH49R) |
| Chemical Name | [1-[(Benzyloxy)methyl]cyclopropyl]methanol |
| IUPAC Name | [1-(phenylmethoxymethyl)cyclopropyl]methanol |
| InChI | InChI=1S/C12H16O2/c13-9-12(6-7-12)10-14-8-11-4-2-1-3-5-11/h1-5,13H,6-10H2 |
| InChI Key | KBGZAPJNEFMKKZ-UHFFFAOYSA-N |
| MDL Number | MFCD26398597 |
| Molecular Formula | C12H16O2 |
| Molecular Weight | 192.2542 |
| SMILES | C(C1=CC=CC=C1)OCC1(CC1)CO |
| Synonyms | (1-((benzyloxy)methyl)cyclopropyl)methanol,
177200-76-9,
1-benzyloxymethyl-1-(hydroxymethyl)cyclopropane,
{1-[(benzyloxy)methyl]cyclopropyl}methanol,
SCHEMBL3488328,
KBGZAPJNEFMKKZ-UHFFFAOYSA-N,
ZINC84249447,
AKOS023401908,
F2147-3621,
|
| Complexity | 169 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 192.115g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 192.258g/mol |
| Monoisotopic Mass | 192.115g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number