4-(tert-Butoxy)-2-chloropyrimidine - CAS 614729-28-1
Catalog: |
BB031125 |
Product Name: |
4-(tert-Butoxy)-2-chloropyrimidine |
CAS: |
614729-28-1 |
Synonyms: |
2-chloro-4-[(2-methylpropan-2-yl)oxy]pyrimidine; 2-chloro-4-[(2-methylpropan-2-yl)oxy]pyrimidine |
IUPAC Name: | 2-chloro-4-[(2-methylpropan-2-yl)oxy]pyrimidine |
Description: | 4-(tert-Butoxy)-2-chloropyrimidine (CAS# 614729-28-1) is a useful research chemical. |
Molecular Weight: | 186.64 |
Molecular Formula: | C8H11ClN2O |
Canonical SMILES: | CC(C)(C)OC1=NC(=NC=C1)Cl |
InChI: | InChI=1S/C8H11ClN2O/c1-8(2,3)12-6-4-5-10-7(9)11-6/h4-5H,1-3H3 |
InChI Key: | PZFBNKHDNDRSQO-UHFFFAOYSA-N |
LogP: | 2.30730 |
Publication Number | Title | Priority Date |
AU-2003213361-A1 | Nitrogenous heterocyclic compound and medicine thereof | 20020314 |
AU-2003213361-B2 | Nitrogenous heterocyclic compound and medicine thereof | 20020314 |
CA-2477839-C | Nitrogen containing heterocyclic compounds and medicines containing the same | 20020314 |
DE-60315265-T2 | NITROGENIC HETEROCYCLIC COMPOUND AND MEDICINES THEREOF | 20020314 |
EP-1484327-A1 | Nitrogenous heterocyclic compound and medicine thereof | 20020314 |
Complexity: | 147 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 186.0559907 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 186.0559907 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 35 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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