5-(4-Fluorophenyl)-1,2-dimethyl-1H-pyrrole-3-carboxylic Acid - CAS 891764-80-0
Catalog: |
BB039361 |
Product Name: |
5-(4-Fluorophenyl)-1,2-dimethyl-1H-pyrrole-3-carboxylic Acid |
CAS: |
891764-80-0 |
Synonyms: |
5-(4-fluorophenyl)-1,2-dimethyl-3-pyrrolecarboxylic acid; 5-(4-fluorophenyl)-1,2-dimethylpyrrole-3-carboxylic acid |
IUPAC Name: | 5-(4-fluorophenyl)-1,2-dimethylpyrrole-3-carboxylic acid |
Description: | 5-(4-Fluorophenyl)-1,2-dimethyl-1H-pyrrole-3-carboxylic Acid (CAS# 891764-80-0) is a useful research chemical compound. |
Molecular Weight: | 233.24 |
Molecular Formula: | C13H12FNO2 |
Canonical SMILES: | CC1=C(C=C(N1C)C2=CC=C(C=C2)F)C(=O)O |
InChI: | InChI=1S/C13H12FNO2/c1-8-11(13(16)17)7-12(15(8)2)9-3-5-10(14)6-4-9/h3-7H,1-2H3,(H,16,17) |
InChI Key: | OAKQOMKKKBNYCI-UHFFFAOYSA-N |
Publication Number | Title | Priority Date |
US-2014073632-A1 | Treating protein folding disorders with small molecule cftr correctors | 20110517 |
US-9221840-B2 | Treating protein folding disorders with small molecule CFTR correctors | 20110517 |
WO-2012158913-A2 | Treating protein folding disorders with small molecule cftr correctors | 20110517 |
Complexity: | 289 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 233.08520679 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 233.08520679 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 42.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Carbonyl Compounds
Customers Also Viewed
-
[163702-08-7]
Methyl perfluoroisobutyl ether
-
[132182-92-4]
Pentane, 1,1,1,2,2,3,4,5,5,5-decafluoro-3-methoxy-4-(trifluoromethyl)-
-
[875573-66-3]
Estra-1,3,5(10)-triene-3,17-diol,7-(9-bromononyl)-,17-acetate,(7a,17b)-
-
[79551-14-7]
Ferene Disodium Salt
-
[3735-92-0]
Methyl dimethyldithiocarbamate
-
[1643-20-5]
N,N-dimethyldodecan-1-amine oxide
INDUSTRY LEADERS TRUST OUR PRODUCTS