2-(3,5-Dimethylphenyl)pyrrole - CAS 1782117-21-8
Catalog: |
BB013416 |
Product Name: |
2-(3,5-Dimethylphenyl)pyrrole |
CAS: |
1782117-21-8 |
Synonyms: |
2-(3,5-dimethylphenyl)-1H-pyrrole; 2-(3,5-dimethylphenyl)-1H-pyrrole |
IUPAC Name: | 2-(3,5-dimethylphenyl)-1H-pyrrole |
Description: | 2-(3,5-Dimethylphenyl)pyrrole (CAS# 1782117-21-8 ) is a useful research chemical. |
Molecular Weight: | 171.24 |
Molecular Formula: | C12H13N |
Canonical SMILES: | CC1=CC(=CC(=C1)C2=CC=CN2)C |
InChI: | InChI=1S/C12H13N/c1-9-6-10(2)8-11(7-9)12-4-3-5-13-12/h3-8,13H,1-2H3 |
InChI Key: | KXSHGUHNGUPEOO-UHFFFAOYSA-N |
Publication Number | Title | Priority Date |
US-2017137430-A1 | Nuclear Transport Modulators And Uses Thereof | 20110729 |
US-9428490-B2 | Nuclear transport modulators and uses thereof | 20110729 |
EP-1753773-A1 | Transition metal compounds for olefin polymerization and oligomerization | 20040526 |
WO-2005118605-A1 | Transition metal compounds for olefin polymerization and oligomerization | 20040526 |
CN-1074933-C | Anti-stress, anti-impairment and anti-aging drug and process for manufacturing thereof | 19940602 |
Complexity: | 157 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 171.104799419 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 0 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 171.104799419 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 15.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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