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5,6,7,8-Tetrahydro-1-naphthylamine - 98%, high purity , CAS No.2217-41-6
Basic Description
Synonyms
5-Aminotetralin | UNII-U0L74S8K6G | 5-Tetralinylamine | A0995 | A4767 | U0L74S8K6G | .alpha.-Tetrahydronaphthylamine | 1-Amino-5,6,7,8-tetrahydronaphthaline | 5-Tetralylamine | 4-12-00-02934 (Beilstein Handbook Reference) | 5,6,7,8-Tetrahydro-1-naphthylam
Specifications & Purity
≥98%
Storage Temp
Argon charged
Shipped In
Normal
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Tetralins
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Tetralins
Alternative Parents
Primary amines Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Tetralin - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Amine - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as tetralins. These are polycyclic aromatic compounds containing a tetralin moiety, which consists of a benzene fused to a cyclohexane.
External Descriptors
Not available
Data sources
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
Names and Identifiers
Pubchem Sid
488182276
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/488182276
IUPAC Name
5,6,7,8-tetrahydronaphthalen-1-amine
INCHI
InChI=1S/C10H13N/c11-10-7-3-5-8-4-1-2-6-9(8)10/h3,5,7H,1-2,4,6,11H2
InChIKey
SODWJACROGQSMM-UHFFFAOYSA-N
Smiles
C1CCC2=C(C1)C=CC=C2N
Isomeric SMILES
C1CCC2=C(C1)C=CC=C2N
WGK Germany
3
RTECS
QM4780000
PubChem CID
16671
Molecular Weight
147.22
Beilstein
387264
Reaxy-Rn
387264
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Solubility
Miscible with Alcohol
Sensitivity
Air Sensitive
Refractive Index
1.59
Flash Point(°F)
235.4 °F
Flash Point(°C)
>110°C
Boil Point(°C)
275-277°C
Melt Point(°C)
38°C
Molecular Weight
147.220 g/mol
XLogP3
2.600
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
1
Rotatable Bond Count
0
Exact Mass
147.105 Da
Monoisotopic Mass
147.105 Da
Topological Polar Surface Area
26.000 Ų
Heavy Atom Count
11
Formal Charge
0
Complexity
133.000
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
The total count of all stereochemical bonds
0
Covalently-Bonded Unit Count
1
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