| CAS Number | 1250167-12-4 |
| Catalog Number | AG01AB2O(AGN-PC-0WO8IY) |
| Chemical Name | [1-(Prop-2-yn-1-yl)pyrrolidin-2-yl]methanol |
| IUPAC Name | (1-prop-2-ynylpyrrolidin-2-yl)methanol |
| InChI | InChI=1S/C8H13NO/c1-2-5-9-6-3-4-8(9)7-10/h1,8,10H,3-7H2 |
| InChI Key | MFSYXXIWVDCEDQ-UHFFFAOYSA-N |
| MDL Number | MFCD14660783 |
| Molecular Formula | C8H13NO |
| Molecular Weight | 139.1949 |
| SMILES | OCC1N(CC#C)CCC1 |
| Synonyms | [1-(prop-2-yn-1-yl)pyrrolidin-2-yl]methanol,
1250167-12-4,
AC1Q7C9Q,
MFSYXXIWVDCEDQ-UHFFFAOYA,
SCHEMBL1414126,
AKOS010671008,
EN300-70289,
InChI=1/C8H13NO/c1-2-5-9-6-3-4-8(9)7-10/h1,8,10H,3-7H2,
|
| Complexity | 147 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 139.1g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 139.198g/mol |
| Monoisotopic Mass | 139.1g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 23.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.2 |
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Certificate of Analysis
Lot Number