5,6,7,8-Tetrahydroisoquinoline - ≥98% , CAS No.36556-06-6

CAS: 36556-06-6 Cat. No.: T162590 Molecular Weight: 133.19 Beilstein Registry Number: 20(3/4)2948 EC Number: 253-098-4 PubChem CID: 119010
AVAILABLE TO ORDER
GRADE & PURITY ≥98%
Synonyms
MFCD00012168 | InChI=1/C9H11N/c1-2-4-9-7-10-6-5-8(9)3-1/h5-7H,1-4H | SCHEMBL28211 | Z104492180 | Q63408733 | BDBM50369456 | T1230 | EN300-21119 | SB36851 | SY029025 | AKOS000121445 | 5,6,7,8-Tetrahydroisoquinoline, 95% | FT-0649653 | EINECS 253-098-4 | AM
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
5ml
T162590-5ml
5
$25.90
25ml
T162590-25ml
1
$124.90
100ml
T162590-100ml
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$375.90
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Why this grade

≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships Normal 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
MFCD00012168 | InChI=1/C9H11N/c1-2-4-9-7-10-6-5-8(9)3-1/h5-7H, 1-4H | SCHEMBL28211 | Z104492180 | Q63408733 | BDBM50369456 | T1230 | EN300-21119 | SB36851 | SY029025 | AKOS000121445 | 5, 6, 7, 8-Tetrahydroisoquinoline, 95% | FT-0649653 | EINECS 253-098-4 | AM
Specifications & Purity
≥98%
Storage
Room temperature
Shipped In
Normal
Purity
≥98%
Names and Identifiers
Pubchem Sid504756801
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504756801
Canonical SmilesC1CCC2=C(C1)C=CN=C2
IUPAC Name5,6,7,8-tetrahydroisoquinoline
InChIKeyHTMGQIXFZMZZKD-UHFFFAOYSA-N
INCHI1S/C9H11N/c1-2-4-9-7-10-6-5-8(9)3-1/h5-7H,1-4H2
Isomeric SMILES C1CCC2=C(C1)C=CN=C2
WGK Germany 3
PubChem CID 119010
Molecular Weight 133.19
Beilstein 20(3/4)2948
Reaxy-Rn 116144

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.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClassPyridines and derivatives
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentPyridines and derivatives
Alternative Parents Heteroaromatic compounds  Azacyclic compounds  Organopnictogen compounds  Organonitrogen compounds  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Pyridine - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteropolycyclic compound
DescriptionThis compound belongs to the class of organic compounds known as pyridines and derivatives. These are compounds containing a pyridine ring, which is a six-member aromatic heterocycle which consists of one nitrogen atom and five carbon atoms.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
SIGMAR1 Tclin Sigma non-opioid intracellular receptor 1 (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
Mechanisms of Action
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

3 results found

Lot NumberCertificate TypeDateItem
F1721093Certificate of AnalysisJan 08, 2025 T162590
L2015083Certificate of AnalysisOct 22, 2024 T162590
K2230150Certificate of AnalysisDec 08, 2022 T162590
Chemical and Physical Properties
SensitivityAir Sensitive
Refractive Index1.54
Flash Point(°F)212 °F
Flash Point(°C)100 °C
Boil Point(°C)81 °C/1 mmHg
Molecular Weight133.190 g/mol
XLogP32.200
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass133.089 Da
Monoisotopic Mass133.089 Da
Topological Polar Surface Area12.900 Ų
Heavy Atom Count10
Formal Charge0
Complexity111.000
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
Reviews

Customer Reviews

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