| CAS Number | 1820703-95-4 |
| Catalog Number | AG00I0WA(AGN-PC-0WQZSA) |
| Chemical Name | 3-[3-(Pyrazol-1-yl)propoxy]propan-1-ol |
| IUPAC Name | 3-(3-pyrazol-1-ylpropoxy)propan-1-ol |
| InChI | InChI=1S/C9H16N2O2/c12-7-3-9-13-8-2-6-11-5-1-4-10-11/h1,4-5,12H,2-3,6-9H2 |
| InChI Key | KUIXEGAZBUDMBF-UHFFFAOYSA-N |
| MDL Number | MFCD28024842 |
| Molecular Formula | C9H16N2O2 |
| Molecular Weight | 184.2355 |
| SMILES | OCCCOCCCn1cccn1 |
| Synonyms | 3-[3-(PYRAZOL-1-YL)PROPOXY]PROPAN-1-OL,
1820703-95-4,
ZINC169725154,
|
| Complexity | 122 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 184.121178g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 184.24g/mol |
| Monoisotopic Mass | 184.121178g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 47.3Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number