Basic information
- CAS
370-14-9- Standard SMILES
CNC(C)Cc1ccc(O)cc1- InChIKey
SBUQZKJEOOQSBV-UHFFFAOYSA-N- Molecular formula
- C10H15NO
- Average molar mass
- 165.23 g/mol
- Monoisotopic mass
- 165.1153641
Overview
Pholedrine is a member of amphetamines.
Names & identifiers
- Preferred name
- (+-)-Pholedrine
- IUPAC
- 4-[2-(methylamino)propyl]phenol
- English name
- p-Hydroxymethamphetamine
- Molecular formula
- C10H15NO
- Molecular weight
- 165.23
Names & synonyms
PholedrineIsodrinePulsotylPressitan370-14-9Racemic pholedrinePholedrinum4-Hydroxy-N-methylamphetaminep-(2-Methylaminopropyl)phenolIsodrin (sympathomimetic)Oh-ma1-(p-Hydroxyphenyl)-2-methylaminopropane
Show more names
epifenvaritolVeritolfoledrinknollh75prometinveritainisodrinum
p-Hydroxy-N-methylamphetamineFoledrinap-Hydroxy-N,alpha-dimethylphenethylaminebeta-(p-Hydroxyphenyl)isopropylmethylamineKNOLL-H75PHENOL, p-(2-(METHYLAMINO)PROPYL)-AY28O44JGDalpha-(p-Hydroxyphenyl)-beta-methylaminopropane
Database identifiers
- CAS
370-14-9- PubChem CID
- 4655
- DTXSID
DTXSID70861908- ChEMBL
CHEMBL2008672- ChEBI
CHEBI:134798- UNII
- AY28O44JGD
- EC Number
- 206-725-0
- Nikkaji
- J443.118I、J443.119G、J5.707J
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 119
Experimental & physicochemical properties
Human DrugsPharmaceuticals
Physicochemical properties
- Melting point
- 162 · 162-163°
- Boiling point
- 293.09 °C · 293.09°C (rough estimate)
- Density
- 1.0203 · 1.0203 (rough estimate)
- refractive index
- 1.482 · 1.4820 (estimate)
- storage temp.
- 20 °C · −20°C
- solubility
- Methanol (Slightly)
- pka
- 9.82 · 9.82±0.15(Predicted)
- Major Application
- forensics and toxicologypharmaceutical (small molecule)veterinary
- InChI
- 1S/C10H15NO/c1-8(11-2)7-9-3-5-10(12)6-4-9/h3-6,8,11-12H,7H2,1-2H3
- InChIKey
- SBUQZKJEOOQSBV-UHFFFAOYSA-N
- SMILES
- CNC(C)Cc1ccc(O)cc1
- FDA UNII
- 28 O44JGD · AY28O44JGD
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
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 3
- rtecs
- SL8400000
- Toxicity
- LD50 parenteral in mouse: 100mg/kg
- risk_code
- 36/37/38-39/23/24/25-23/24/25-11
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi,T,F
- safety_code
- 26-36-45-36/37-16-7
- Storage Class
- 11 - Combustible Solids
- target organs
- Respiratory system
- Hazard statements
- H315-H319-H335
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- Precautionary statements
- P261-P264-P271-P280-P302+P352-P305+P351+P338
Chemistry & industry
Pharmacology
Metabolism/MetabolitesHO-MA is a known human metabolite of p-Methoxymethamphetamine, R-(-)-.
MeSH Pharmacological Classification
A loosely defined group of drugs that tend to increase behavioral alertness, agitation, or excitation. They work by a variety of mechanisms, but usually not by direct excitation of neurons. The many drugs that have such actions as side effects to their main therapeutic use are not included here.
Drugs that mimic the effects of stimulating postganglionic adrenergic sympathetic nerves. Included here are drugs that directly stimulate adrenergic receptors and drugs that act indirectly by provoking the release of adrenergic transmitters.
Tissue LocationsKidney
Cellular LocationsCytoplasm
Uses & manufacturing
Use ClassificationPharmaceuticals
Applications
UsesAn a-adrenergic agonist. Antihypotensive.
Upstream & downstream products
Upstream raw materials
Additional notes
DefinitionChEBI: Pholedrine is a member of amphetamines.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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