| CAS Number | 1007516-30-4 |
| Catalog Number | AG0002SX(AGN-PC-0WB38V) |
| Chemical Name | 3-(1-Ethyl-1H-pyrazol-4-yl)propan-1-ol |
| IUPAC Name | 3-(1-ethylpyrazol-4-yl)propan-1-ol |
| InChI | InChI=1S/C8H14N2O/c1-2-10-7-8(6-9-10)4-3-5-11/h6-7,11H,2-5H2,1H3 |
| InChI Key | RBDCVYLLOQIZIV-UHFFFAOYSA-N |
| MDL Number | MFCD08059737 |
| Molecular Formula | C8H14N2O |
| Molecular Weight | 154.2096 |
| SMILES | N1=CC(=CN1CC)CCCO |
| Synonyms | 3-(1-Ethyl-1H-pyrazol-4-yl)propan-1-ol,
1007516-30-4,
SCHEMBL16831283,
CTK3J9212,
DTXSID80629692,
1H-Pyrazole-4-propanol, 1-ethyl-,
MFCD08059737,
ZINC19088201,
AKOS003672726,
AJ-70926,
DA-18605,
3-(1-Ethyl-1H-pyrazol-4-yl)-1-propanol,
FT-0763074,
Y-3334,
3-(1-Ethyl-1H-pyrazol-4-yl)propan-1-ol, AldrichCPR,
F2147-6881,
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| Complexity | 108 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 154.111g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 154.213g/mol |
| Monoisotopic Mass | 154.111g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 38A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
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Certificate of Analysis
Lot Number