| CAS Number | 1269291-96-4 |
| Catalog Number | AG000TIP(AGN-PC-0WA223) |
| Chemical Name | (3-Isopropylcyclobutyl)methanol |
| IUPAC Name | (3-propan-2-ylcyclobutyl)methanol |
| InChI | InChI=1S/C8H16O/c1-6(2)8-3-7(4-8)5-9/h6-9H,3-5H2,1-2H3 |
| InChI Key | FVHPFGGDBCIDRZ-UHFFFAOYSA-N |
| MDL Number | MFCD18801139 |
| Molecular Formula | C8H16O |
| Molecular Weight | 128.2120 |
| SMILES | CC(C1CC(CO)C1)C |
| Synonyms | (3-isopropylcyclobutyl)methanol,
1269291-96-4,
SCHEMBL254990,
SCHEMBL10216419,
SCHEMBL10216587,
DTXSID20680560,
(3-propan-2-ylcyclobutyl)methanol,
MFCD18801139,
ZINC67175834,
[3-(Propan-2-yl)cyclobutyl]methanol,
AKOS015841694,
FCH2619315,
BBV-38718385,
DA-13080,
AJ-116912,
AX8224189,
TC-071684,
FT-0743676,
(3-Isopropyl-cyclobutyl)-methanol,
ACN-039663,
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| Complexity | 82.6 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 128.12g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 128.215g/mol |
| Monoisotopic Mass | 128.12g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number