| CAS Number | 18729-46-9 |
| Catalog Number | AG00AR42(AGN-PC-0QGEGC) |
| Chemical Name | 1-Cyclopropylpropan-1-ol |
| IUPAC Name | 1-cyclopropylpropan-1-ol |
| InChI | InChI=1S/C6H12O/c1-2-6(7)5-3-4-5/h5-7H,2-4H2,1H3 |
| InChI Key | ZVTCOQDWIJYYSQ-UHFFFAOYSA-N |
| MDL Number | MFCD12153709 |
| Molecular Formula | C6H12O |
| Molecular Weight | 100.1589 |
| SMILES | CCC(O)C1CC1 |
| Synonyms | 1-cyclopropylpropan-1-ol,
18729-46-9,
1-cyclopropyl-1-propanol,
1?cyclopropylpropan?1?ol,
1-cyclopropyl-propan-1-ol,
alpha-Ethylcyclopropanmethanol,
SCHEMBL126585,
(1S)-1-cyclopropylpropan-1-ol,
(1R)-1-Cyclopropylpropan-1-ol,
KS-000005FW,
MFCD12153709,
AKOS010015067,
AS-52531,
CS-0052573,
1567853-89-7,
1567978-45-3,
1cyclopropylpropan1ol,
CID10329254,
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| 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 | 1.2 |
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Certificate of Analysis
Lot Number