4-Methyl-2-phenyl-1H-pyrrole - CAS 20055-04-3
Catalog: |
BB015483 |
Product Name: |
4-Methyl-2-phenyl-1H-pyrrole |
CAS: |
20055-04-3 |
Synonyms: |
4-methyl-2-phenyl-1H-pyrrole; 4-methyl-2-phenyl-1H-pyrrole |
IUPAC Name: | 4-methyl-2-phenyl-1H-pyrrole |
Description: | 4-Methyl-2-phenyl-1H-pyrrole (CAS# 20055-04-3 ) is a useful research chemical. |
Molecular Weight: | 157.21 |
Molecular Formula: | C11H11N |
Canonical SMILES: | CC1=CNC(=C1)C2=CC=CC=C2 |
InChI: | InChI=1S/C11H11N/c1-9-7-11(12-8-9)10-5-3-2-4-6-10/h2-8,12H,1H3 |
InChI Key: | YIAAMAHGPLMCJP-UHFFFAOYSA-N |
LogP: | 2.99010 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-110283159-A | Tri- substituted azole of 2,3- disubstituted pyrroles or 2,3,4- and preparation method thereof of one kettle way preparation | 20190717 |
CN-110283159-B | 2, 4-disubstituted pyrrole or 2,3, 4-trisubstituted pyrrole prepared by one-pot method and preparation method thereof | 20190717 |
RU-2677470-C2 | Process for the preparation of 3-alkyl(phenyl)-2,5-diphenyl-1h-pyrroles | 20170710 |
US-2020165519-A1 | Polymerizable liquid crystal composition and retardation plate | 20170609 |
US-2017335191-A1 | Liquid crystal composition | 20160523 |
Complexity: | 138 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 157.089149355 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 0 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 157.089149355 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 15.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.7 |
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