Basic information
- CAS
298690-91-2- Standard SMILES
CCc1ccc(C2CCCN2)cc1- InChIKey
IBPIAQWYWUWFPS-UHFFFAOYSA-N- Molecular formula
- C12H17N
- Average molar mass
- 175.27 g/mol
- Monoisotopic mass
- 175.13609955
Names & identifiers
- Preferred name
- 2-(4-Ethylphenyl)pyrrolidine
- IUPAC
- 2-(4-ethylphenyl)pyrrolidine
- English name
- 2-(4-ethylphenyl)pyrrolidine
- Molecular formula
- C12H17N
- Molecular weight
- 175.27
Names & synonyms
2-(4-ethylphenyl)pyrrolidine298690-91-2MFCD02663526(S)-2-(4-ETHYLPHENYL)PYRROLIDINE1217760-03-6SCHEMBL716893IBPIAQWYWUWFPS-UHFFFAOYSA-NPyrrolidine, 2-(4-ethylphenyl)-AKOS000166569(RS)-2-(4-ethyl-phenyl)-pyrrolidineSY253432CS-0296677
Show more names
N10899EN300-1843366F709619
Database identifiers
- CAS
298690-91-2- PubChem CID
- 3901423
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 147
Physicochemical properties
- Boiling point
- 278 ℃ · 278℃
- Density
- 0.964 · 0.964
- Flash point
- 124 ℃ · 124℃
Chemistry & industry
Suppliers6 total
北京蓝博特科技有限公司010-56330744 18310155299 · [email protected]
上海策嵘生物科技有限公司（定制合成实验室）13917420128 13062833949 · [email protected]
河北博新生物科技有限公司19131160546 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海研邦医药科技有限公司15618536883 · [email protected]
重庆卡兰医药有限公司[email protected]
Related reactions
4 records
Compound notes
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