5-Propoxytryptamine , CAS No.3610-40-0

CAS: 3610-40-0 Cat. No.: P669109 Molecular Weight: 218.29 EC Number: 155-190-9 PubChem CID: 10751317
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Synonyms
5-Propoxytryptamine | 2-(5-propoxy-1H-indol-3-yl)ethanamine | 2-(5-propoxy-1H-indol-3-yl)ethan-1-amine | 1H-Indole-3-ethanamine, 5-propoxy- | 5-Propoxy-1H-indole-3-ethanamine | NIOSH/NL4391000 | DTXSID40189681 | 3-(2-Aminoethyl)-5-propoxyindole | BDBM5004
Storage
Room temperature
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Size
Status
Price
Qty
1mg
P669109-1mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

$571.90

$999.90
Save $428.00 (42.80%)
5mg
P669109-5mg
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.

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Storage & shipping

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

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Quality documents

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

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Literature proof

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

Specifications

Synonyms
5-Propoxytryptamine | 2-(5-propoxy-1H-indol-3-yl)ethanamine | 2-(5-propoxy-1H-indol-3-yl)ethan-1-amine | 1H-Indole-3-ethanamine, 5-propoxy- | 5-Propoxy-1H-indole-3-ethanamine | NIOSH/NL4391000 | DTXSID40189681 | 3-(2-Aminoethyl)-5-propoxyindole | BDBM5004
Storage
Room temperature
Product Properties
ALogP1.4
Names and Identifiers
Canonical SmilesCCCOC1=CC2=C(C=C1)NC=C2CCN
IUPAC Name2-(5-propoxy-1H-indol-3-yl)ethanamine
InChIKeySXHSCDTUUHPMSY-UHFFFAOYSA-N
INCHI1S/C13H18N2O/c1-2-7-16-11-3-4-13-12(8-11)10(5-6-14)9-15-13/h3-4,8-9,15H,2,5-7,14H2,1H3
Isomeric SMILES CCCOC1=CC2=C(C=C1)NC=C2CCN
PubChem CID 10751317
Molecular Weight 218.29

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.

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📊 Datasheet

Quick-reference summary of product specifications and applications.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

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Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClassIndoles and derivatives
SubclassTryptamines and derivatives
Intermediate Tree Nodes Not available
Direct ParentTryptamines and derivatives
Alternative Parents 3-alkylindoles  Phenol ethers  2-arylethylamines  Aralkylamines  Alkyl aryl ethers  Substituted pyrroles  Heteroaromatic compounds  Azacyclic compounds  Monoalkylamines  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Tryptamine - 3-alkylindole - Indole - 2-arylethylamine - Phenol ether - Alkyl aryl ether - Aralkylamine - Benzenoid - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Ether - Azacycle - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Organic oxygen compound - Organic nitrogen compound - Primary amine - Amine - Aromatic heteropolycyclic compound
DescriptionThis compound belongs to the class of organic compounds known as tryptamines and derivatives. These are compounds containing the tryptamine backbone, which is structurally characterized by an indole ring substituted at the 3-position by an ethanamine.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
HTR1B Tclin 5-hydroxytryptamine receptor 1B (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
HTR1A Tclin 5-hydroxytryptamine receptor 1A (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
HTR1A Tclin Serotonin 1a (5-HT1a) receptor (14969 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HTR1B Tclin Serotonin 1b (5-HT1b) receptor (2801 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 Weight218.290 g/mol
XLogP31.400
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Exact Mass218.142 Da
Monoisotopic Mass218.142 Da
Topological Polar Surface Area51.000 Ų
Heavy Atom Count16
Formal Charge0
Complexity210.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Solution Calculators
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