Completing data — usually done within a minute
Basic information
- CAS
72219-19-3- Standard SMILES
Oc1ccc(CN2CCCC2)cc1- InChIKey
YLMRZQGEWJVGBB-UHFFFAOYSA-N- Molecular formula
- C11H15NO
- Average molar mass
- 177.24 g/mol
- Monoisotopic mass
- 177.1153641
Names & identifiers
- Preferred name
- 4-(Pyrrolidin-1-ylmethyl)phenol
- IUPAC
- 4-(pyrrolidin-1-ylmethyl)phenol
Names & synonyms
72219-19-34-(Pyrrolidin-1-ylmethyl)phenolPhenol, 4-(1-pyrrolidinylmethyl)-1-(4-hydroxybenzyl)pyrrolidineoxybenzyl pyrrolidine4-hydroxybenzyl-pyrrolidineOprea1_7422204-pyrrolidin-1-ylmethylphenolSCHEMBL3223054-(1-pyrrolidinylmethyl)phenol4-pyrrolidin-1-ylmethyl-phenolSCHEMBL5345661
Show more names
DTXSID60596151YLMRZQGEWJVGBB-UHFFFAOYSA-N4-[(Pyrrolidin-1-yl)methyl]phenolAKOS006229703AT16757DB-290754
Database identifiers
- CAS
72219-19-3- PubChem CID
- 18771978
- DTXSID
DTXSID60596151
Properties
Computed structural propertiesFilling in
- XLogP
- 1.9
- Topological polar surface area
- 23.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 146
Related reactions
18 records
Compound notes
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