Basic information
- CAS
27325-36-6- Standard SMILES
CC(C)NCC(O)COc1ccccc1C1CC1- InChIKey
RTAGQMIEWAAKMO-UHFFFAOYSA-N- Molecular formula
- C15H23NO2
- Average molar mass
- 249.35 g/mol
- Monoisotopic mass
- 249.17287898
Overview
RN given refers to parent cpd & from CAS Registry Handbook, Numbers Section, 1965-1971; structure
Names & identifiers
- Preferred name
- Procinolol
- IUPAC
- 1-(2-cyclopropylphenoxy)-3-(propan-2-ylamino)propan-2-ol
- English name
- Procinolol
- Molecular formula
- C15H23NO2
- Molecular weight
- 249.35
Names & synonyms
Procinolol27325-36-6ProcinololumSD 2124-01SD-2124-01SLJ0HIL21J1-(2-cyclopropylphenoxy)-3-isopropylaminopropan-2-olRefChem:1761271-(o-cyclopropylphenoxy)-3-isopropylaminopropan-2-ol1-(2-cyclopropylphenoxy)-3-(propan-2-ylamino)propan-2-ol1-(2-Cyclopropylphenoxy)-3-[(propan-2-yl)amino]propan-2-ol(+/-)-Procinolol; SD 2124-01
Show more names
1-(2-Cyclopropylphenoxy)-3-(isopropylamino)-2-propanol2-Propanol, 1-(2-cyclopropylphenoxy)-3-[(1-methylethyl)amino]-
Procinolol [INN:DCF]UNII-SLJ0HIL21JProcinololum [INN-Latin]PROCINOLOL [INN]C-1755(+/-)-PROCINOLOLorb1739947SCHEMBL1254736
Database identifiers
- CAS
27325-36-6- PubChem CID
- 71707
- DTXSID
DTXSID90865362- ChEMBL
CHEMBL1159892- UNII
- SLJ0HIL21J
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 41.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 241
Experimental & physicochemical properties
LogP3.07
Physicochemical properties
- Melting point
- 69 · 69-73°C
- Boiling point
- 402.2 · 402.2±40.0 °C(Predicted)
- Density
- 1.079 · 1.079±0.06 g/cm3(Predicted)
- storage temp.
- -20 °C · -20°C Freezer
- solubility
- Methanol (Slightly)
- pka
- 13.88 · 13.88±0.20(Predicted)
- form
- Solid
- color
- White to Off-White
- FDA UNII
- 0 HIL21J · SLJ0HIL21J
Chemistry & industry
Applications
UsesProcinolol is a beta adrenergic receptor antagonist. It is also an intermediate in synthesizing (±)-Procinolol Hydrochloride (P755815).
Suppliers5 total
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
北京百奥创新科技有限公司15522676233 · [email protected]
艾吉析科技（上海）有限公司17717235263 17717235263 · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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