2-(2,4-Dimethylphenyl)pyrrole - CAS 142425-96-5
Catalog: |
BB009372 |
Product Name: |
2-(2,4-Dimethylphenyl)pyrrole |
CAS: |
142425-96-5 |
Synonyms: |
2-(2,4-dimethylphenyl)-1H-pyrrole; 2-(2,4-dimethylphenyl)-1H-pyrrole |
IUPAC Name: | 2-(2,4-dimethylphenyl)-1H-pyrrole |
Description: | 2-(2,4-Dimethylphenyl)pyrrole (CAS# 142425-96-5 ) is a useful research chemical. |
Molecular Weight: | 171.24 |
Molecular Formula: | C12H13N |
Canonical SMILES: | CC1=CC(=C(C=C1)C2=CC=CN2)C |
InChI: | InChI=1S/C12H13N/c1-9-5-6-11(10(2)8-9)12-4-3-7-13-12/h3-8,13H,1-2H3 |
InChI Key: | AJLPODHTDFKAEI-UHFFFAOYSA-N |
LogP: | 0.00000 |
Publication Number | Title | Priority Date |
US-2002052526-A1 | Antimicrobial 2-deoxystreptamine compounds | 19991201 |
US-2003109461-A1 | Antimicrobial 2-deoxystreptamine compounds | 19991201 |
US-6759523-B2 | Antimicrobial 2-deoxystreptamine compounds | 19991201 |
US-6967242-B2 | Antimicrobial 2-deoxystreptamine compounds | 19991201 |
WO-0139726-A2 | Antimicrobial 2-deoxystreptamine compounds | 19991201 |
Complexity: | 167 |
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: | 3.1 |
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