Basic information
- CAS
1507-81-9- Standard SMILES
CCCC1(c2ccc(O)cc2)CCN(C)C1- InChIKey
BFYUBQQTQCXHIA-UHFFFAOYSA-N- Molecular formula
- C14H21NO
- Average molar mass
- 219.32 g/mol
- Monoisotopic mass
- 219.16231429
Names & identifiers
- Preferred name
- Phenol, p-(1-methyl-3-propyl-3-pyrrolidinyl)-
- IUPAC
- 4-(1-methyl-3-propylpyrrolidin-3-yl)phenol
Names & synonyms
Phenol, p-(1-methyl-3-propyl-3-pyrrolidinyl)-1507-81-9RefChem:1094939BRN 1459607p-(1-Methyl-3-propyl-3-pyrrolidinyl)phenol4-(1-methyl-3-propylpyrrolidin-3-yl)phenol1-Methyl-3-(p-hydroxyphenyl)-3-propylpyrrolidine3-(p-Hydroxyphenyl)-1-methyl-3-propylpyrrolidineDTXSID50934048
Database identifiers
- CAS
1507-81-9- PubChem CID
- 200321
- DTXSID
DTXSID50934048- Nikkaji
- J86.614H
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 23.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 223
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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