| CAS Number | 864867-28-7 |
| Catalog Number | AG01BVT1(AGN-PC-03ZD0I) |
| Chemical Name | (3-Methoxycyclobutyl)methanol |
| IUPAC Name | (3-methoxycyclobutyl)methanol |
| InChI | InChI=1S/C6H12O2/c1-8-6-2-5(3-6)4-7/h5-7H,2-4H2,1H3 |
| InChI Key | XIICKNMLKKNTGN-UHFFFAOYSA-N |
| MDL Number | MFCD20485770 |
| Molecular Formula | C6H12O2 |
| Molecular Weight | 116.1583 |
| SMILES | COC1CC(C1)CO |
| Synonyms | (3-methoxycyclobutyl)methanol,
959600-78-3,
(cis-3-methoxycyclobutyl)methanol,
(trans-3-Methoxycyclobutyl)methanol,
864867-28-7,
2092237-60-8,
cis-(3-Methoxycyclobutyl)methanol,
3-methoxy-cyclobutylmethanol,
SCHEMBL964670,
SCHEMBL964672,
XIICKNMLKKNTGN-UHFFFAOYSA-N,
ZINC59865330,
[(1s,3s)-3-methoxycyclobutyl]methanol, cis,
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| Complexity | 66.9 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 116.084g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 116.16g/mol |
| Monoisotopic Mass | 116.084g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number