3-(1-Ethyl-1H-pyrazol-4-yl)propan-1-ol - CAS 1007516-30-4
Catalog: |
BB000320 |
Product Name: |
3-(1-Ethyl-1H-pyrazol-4-yl)propan-1-ol |
CAS: |
1007516-30-4 |
Synonyms: |
3-(1-ethylpyrazol-4-yl)propan-1-ol |
IUPAC Name: | 3-(1-ethylpyrazol-4-yl)propan-1-ol |
Description: | 3-(1-Ethyl-1H-pyrazol-4-yl)propan-1-ol (CAS# 1007516-30-4) is a useful research chemical. |
Molecular Weight: | 154.21 |
Molecular Formula: | C8H14N2O |
Canonical SMILES: | CCN1C=C(C=N1)CCCO |
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 |
Purity: | 95 % |
LogP: | 0.82790 |
Publication Number | Title | Priority Date |
AU-2014369153-A1 | Nrf2 regulators | 20131218 |
AU-2014369153-B2 | Nrf2 regulators | 20131218 |
AU-2017279668-A1 | Nrf2 regulators | 20131218 |
AU-2017279668-B2 | Nrf2 regulators | 20131218 |
CA-2934216-A1 | Substitued phenyl or benzyl propanote derivatives and pharmaceutical compositiions thereof useful as nrf2 regulators | 20131218 |
Complexity: | 108 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 154.110613074 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 154.110613074 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 38 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.5 |
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Related Functional Groups
Pyrazoles
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