Methyl 3-(4-Nitrophenyl)-1H-pyrrole-2-carboxylate - CAS 902138-24-3
Catalog: |
BB039785 |
Product Name: |
Methyl 3-(4-Nitrophenyl)-1H-pyrrole-2-carboxylate |
CAS: |
902138-24-3 |
Synonyms: |
3-(4-nitrophenyl)-1H-pyrrole-2-carboxylic acid methyl ester; methyl 3-(4-nitrophenyl)-1H-pyrrole-2-carboxylate |
IUPAC Name: | methyl 3-(4-nitrophenyl)-1H-pyrrole-2-carboxylate |
Description: | Methyl 3-(4-Nitrophenyl)-1H-pyrrole-2-carboxylate (CAS# 902138-24-3 ) is a useful research chemical. |
Molecular Weight: | 246.22 |
Molecular Formula: | C12H10N2O4 |
Canonical SMILES: | COC(=O)C1=C(C=CN1)C2=CC=C(C=C2)[N+](=O)[O-] |
InChI: | InChI=1S/C12H10N2O4/c1-18-12(15)11-10(6-7-13-11)8-2-4-9(5-3-8)14(16)17/h2-7,13H,1H3 |
InChI Key: | VWIVHTAPBGSFBE-UHFFFAOYSA-N |
Publication Number | Title | Priority Date |
EP-2794569-A1 | Heterocyclic urea compounds | 20111221 |
WO-2013091011-A1 | Heterocyclic urea compounds | 20111221 |
AU-2006210343-A1 | 1-H-pyrrole-2-carboxamides and imidazole-5-carboxamides and use thereof as FAK, KDR and Tie2 kinase modulators for the treatment of cancer | 20050203 |
CA-2595987-A1 | 1-h-pyrrole-2-carboxamides and imidazole-5-carboxamides and use thereof as fak, kdr and tie2 kinase modulators for the treatment of cancer | 20050203 |
EA-012267-B1 | REPLACE PIRROLES AND IMIDAZOLES CONTAINING THEIR COMPOSITIONS, METHOD OF OBTAINING AND APPLICATION | 20050203 |
Complexity: | 321 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 246.0640568 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 246.0640568 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 87.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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