2-Phenylindolizine
Basic information
- CAS
25379-20-8- Standard SMILES
c1ccc(-c2cc3ccccn3c2)cc1- InChIKey
JMCYJDYOEWQZDE-UHFFFAOYSA-N- Molecular formula
- C14H11N
- Average molar mass
- 193.24 g/mol
- Monoisotopic mass
- 193.08914935
Names & identifiers
- Preferred name
- 2-Phenylindolizine
- IUPAC
- 2-phenylindolizine
- English name
- 2-Phenylindolizine
- Molecular formula
- C14H11N
- Molecular weight
- 193.24
Names & synonyms
2-Phenylindolizine25379-20-82-PhenylindolizinIndolizine, 2-phenyl-2-PHENYLPYRROCOLINEQ5A78AM7NAEINECS 246-925-5NSC-54311DTXSID70180025NSC 543112-PHENYLPYRROLO(1,2-A)PYRIDINERefChem:89091
Show more names
2-PHENYLINDOLIZINE, 99+%
DTXCID80102516246-925-5InChI=1/C14H11N/c1-2-6-12(7-3-1)13-10-14-8-4-5-9-15(14)11-13/h1-11JMCYJDYOEWQZDE-UHFFFAOYSA-N2-Phenyl-indolizineMFCD00014558F0191-0079NSC54311
Database identifiers
- CAS
25379-20-8- PubChem CID
- 96128
- DTXSID
DTXSID70180025- UNII
- Q5A78AM7NA
- EC Number
- 246-925-5
- Nikkaji
- J250.454E
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 4.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 207
Experimental & physicochemical properties
LogP4.29
Physicochemical properties
- Melting point
- 211 · 211-214 °C
- Boiling point
- 319.47 °C · 319.47°C (rough estimate)
- Density
- 1.1061 · 1.1061 (rough estimate)
- refractive index
- 1.585 · 1.5850 (estimate)
- FDA UNII
- 5 A78AM7NA · Q5A78AM7NA
- Hazard statements
- 413 · H413
- Safety Statements
- 24 · 24/25
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]
P273, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 67 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAquatic Chronic 4 (100%)
Safety data
- safety_code
- 24/25
- Hazard statements
- H413
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
8 records
Compound notes
Loading…