Methyl 7-Chloro-1H-indole-4-carboxylate - CAS 503816-69-1
Catalog: |
BB027033 |
Product Name: |
Methyl 7-Chloro-1H-indole-4-carboxylate |
CAS: |
503816-69-1 |
Synonyms: |
7-chloro-1H-indole-4-carboxylic acid methyl ester; methyl 7-chloro-1H-indole-4-carboxylate |
IUPAC Name: | methyl 7-chloro-1H-indole-4-carboxylate |
Description: | Methyl 7-Chloro-1H-indole-4-carboxylate (CAS# 503816-69-1) is a useful research chemical. |
Molecular Weight: | 209.63 |
Molecular Formula: | C10H8ClNO2 |
Canonical SMILES: | COC(=O)C1=C2C=CNC2=C(C=C1)Cl |
InChI: | InChI=1S/C10H8ClNO2/c1-14-10(13)7-2-3-8(11)9-6(7)4-5-12-9/h2-5,12H,1H3 |
InChI Key: | YMAVXLSGYDNOML-UHFFFAOYSA-N |
LogP: | 2.60790 |
Publication Number | Title | Priority Date |
EP-2651919-A1 | Dimeric iap inhibitors | 20101213 |
JP-2013545781-A | Dimer IAP inhibitor | 20101213 |
TW-201307318-A | Dimerized IAP inhibitor | 20101213 |
US-2013309247-A1 | Dimeric iap inhibitors | 20101213 |
US-8993523-B2 | Dimeric IAP inhibitors | 20101213 |
PMID | Publication Date | Title | Journal |
12608837 | 20030307 | Practical synthesis and elaboration of methyl 7-chloroindole-4-carboxylate | The Journal of organic chemistry |
Complexity: | 234 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 209.0243562 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 209.0243562 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 42.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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