Ethyl 2-Isopropyloxazole-4-carboxylate - CAS 1060814-30-3
Catalog: |
BB001797 |
Product Name: |
Ethyl 2-Isopropyloxazole-4-carboxylate |
CAS: |
1060814-30-3 |
Synonyms: |
2-propan-2-yl-4-oxazolecarboxylic acid ethyl ester; ethyl 2-propan-2-yl-1,3-oxazole-4-carboxylate |
IUPAC Name: | ethyl 2-propan-2-yl-1,3-oxazole-4-carboxylate |
Description: | Ethyl 2-Isopropyloxazole-4-carboxylate (CAS# 1060814-30-3 ) is a useful research chemical. |
Molecular Weight: | 183.20 |
Molecular Formula: | C9H13NO3 |
Canonical SMILES: | CCOC(=O)C1=COC(=N1)C(C)C |
InChI: | InChI=1S/C9H13NO3/c1-4-12-9(11)7-5-13-8(10-7)6(2)3/h5-6H,4H2,1-3H3 |
InChI Key: | ZJVPOLAXQXKZFM-UHFFFAOYSA-N |
LogP: | 1.97470 |
Publication Number | Title | Priority Date |
US-2019330239-A1 | Indazole derivatives useful as inhibitors of diacylglyceride o-acyltransferase 2 | 20161118 |
US-2017320874-A1 | 6,5-bicyclic octahydropyrrolopyridine orexin receptor antagonists | 20141219 |
US-9938276-B2 | 6,5-bicyclic octahydropyrrolopyridine orexin receptor antagonists | 20141219 |
US-2016152628-A1 | Tricyclic pyrido-carboxamide derivatives as rock inhibitors | 20130702 |
US-9914740-B2 | Tricyclic pyrido-carboxamide derivatives as rock inhibitors | 20130702 |
Complexity: | 182 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 183.08954328 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 183.08954328 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 52.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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