Ronipamil , CAS No.85247-77-4

CAS: 85247-77-4 Cat. No.: R667928 Molecular Weight: 460.7 PubChem CID: 65638
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Synonyms
Ronipamil | Ronipamil [INN] | BP76593251 | Ronipamilo | Ronipamilum | 2-(3-(methyl(phenethyl)amino)propyl)-2-phenyltetradecanenitrile | Ronipamilum [Latin] | Ronipamilo [Spanish] | UNII-BP76593251 | DTXSID40868883 | (RS)-2-(3-Methylphenethylamino)propyl)-
Storage
Room temperature
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Size
Status
Price
Qty
1mg
R667928-1mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

$571.90

$999.90
Save $428.00 (42.80%)
5mg
R667928-5mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

$1,999.90

$2,999.90
Save $1,000.00 (33.33%)
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Why this grade

for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
Ronipamil | Ronipamil [INN] | BP76593251 | Ronipamilo | Ronipamilum | 2-(3-(methyl(phenethyl)amino)propyl)-2-phenyltetradecanenitrile | Ronipamilum [Latin] | Ronipamilo [Spanish] | UNII-BP76593251 | DTXSID40868883 | (RS)-2-(3-Methylphenethylamino)propyl)-
Storage
Room temperature
Product Properties
ALogP10.5
Names and Identifiers
Canonical SmilesCCCCCCCCCCCCC(CCCN(C)CCC1=CC=CC=C1)(C#N)C2=CC=CC=C2
IUPAC Name2-[3-[methyl(2-phenylethyl)amino]propyl]-2-phenyltetradecanenitrile
InChIKeyKLBJRPVUPJXXCM-UHFFFAOYSA-N
INCHI1S/C32H48N2/c1-3-4-5-6-7-8-9-10-11-18-25-32(29-33,31-22-16-13-17-23-31)26-19-27-34(2)28-24-30-20-14-12-15-21-30/h12-17,20-23H,3-11,18-19,24-28H2,1-2H3
Isomeric SMILES CCCCCCCCCCCCC(CCCN(C)CCC1=CC=CC=C1)(C#N)C2=CC=CC=C2
PubChem CID 65638
Molecular Weight 460.7

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
ClassBenzene and substituted derivatives
SubclassPhenylbutylamines
Intermediate Tree Nodes Not available
Direct ParentPhenylbutylamines
Alternative Parents Phenethylamines  Aralkylamines  Trialkylamines  Nitriles  Organopnictogen compounds  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Phenylbutylamine - Phenethylamine - Aralkylamine - Tertiary aliphatic amine - Tertiary amine - Nitrile - Carbonitrile - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Amine - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as phenylbutylamines. These are compounds containing a phenylbutylamine moiety, which consists of a phenyl group substituted at the fourth carbon by an butan-1-amine.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
EBP Tchem 3-beta-hydroxysteroid-Delta(8),Delta(7)-isomerase (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
SIGMAR1 Tclin Sigma non-opioid intracellular receptor 1 (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
Associated Targets(non-human)
ERG2 C-8 sterol isomerase (237 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Sigmar1 Sigma opioid receptor (160 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mechanisms of Action
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Chemical and Physical Properties
Molecular Weight460.700 g/mol
XLogP310.500
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count19
Exact Mass460.382 Da
Monoisotopic Mass460.382 Da
Topological Polar Surface Area27.000 Ų
Heavy Atom Count34
Formal Charge0
Complexity522.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Solution Calculators
Reviews

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