| CAS Number | 1502415-85-1 |
| Catalog Number | AG001MF3(AGN-PC-0WOEPA) |
| Chemical Name | [1-(propan-2-yl)cyclopropyl]methanol |
| IUPAC Name | (1-propan-2-ylcyclopropyl)methanol |
| InChI | InChI=1S/C7H14O/c1-6(2)7(5-8)3-4-7/h6,8H,3-5H2,1-2H3 |
| InChI Key | OVDQNNRXSNYVBL-UHFFFAOYSA-N |
| MDL Number | MFCD23832663 |
| Molecular Formula | C7H14O |
| Molecular Weight | 114.1855 |
| SMILES | CC(C1(CC1)CO)C |
| Synonyms | [1-(propan-2-yl)cyclopropyl]methanol,
1502415-85-1,
(1-ISOPROPYLCYCLOPROPYL)METHANOL,
SCHEMBL765795,
KS-000005GH,
MFCD23832663,
ZINC87155560,
AKOS018650027,
AS-52912,
Cyclopropanemethanol, 1-(1-methylethyl)-,
CS-0053026,
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| Complexity | 82.4 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 114.104g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 114.188g/mol |
| Monoisotopic Mass | 114.104g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
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Certificate of Analysis
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