| CAS Number | 27649-43-0 |
| Catalog Number | AG002UBH(AGN-PC-0LQ18F) |
| Chemical Name | 3-Phenyl-1H-Pyrrole |
| IUPAC Name | 3-phenyl-1H-pyrrole |
| InChI | InChI=1S/C10H9N/c1-2-4-9(5-3-1)10-6-7-11-8-10/h1-8,11H |
| InChI Key | LJDRAKFYYGCAQC-UHFFFAOYSA-N |
| MDL Number | MFCD06660456 |
| Molecular Formula | C10H9N |
| Molecular Weight | 143.1852 |
| SMILES | C1NC=C(C2=CC=CC=C2)C=1 |
| Synonyms | 3-phenyl-1H-pyrrole,
1H-Pyrrole, 3-phenyl-,
27649-43-0,
3-phenylpyrrole,
AC1NT4OO,
SCHEMBL720957,
CTK1A1100,
KS-00001OYK,
DTXSID20415874,
LJDRAKFYYGCAQC-UHFFFAOYSA-N,
ZINC6744541,
MFCD06660456,
AKOS000365554,
GL-0467,
MCULE-9782551547,
InChI=1/C10H9N/c1-2-4-9(5-3-1)10-6-7-11-8-10/h1-8,11,
Pyrrole, 3-phenyl-,
CID5324110,
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| Complexity | 116 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 143.073g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 0 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 143.189g/mol |
| Monoisotopic Mass | 143.073g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 15.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number