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(5-chlorothiophen-3-yl)methanamine hydrochloride - 97%, high purity , CAS No.1108712-55-5
Discover (5-chlorothiophen-3-yl)methanamine hydrochloride by Aladdin Scientific in 97% for only $1,752.90. Available - in Ligands at Aladdin Scientific. Tags: .
Basic Description
Synonyms
1108712-55-5 | (5-Chlorothiophen-3-yl)methanamine hydrochloride | 5-CHLORO-3-THIOPHENEMETHANAMINE HYDROCHLORIDE | (5-chlorothiophen-3-yl)methanamine;hydrochloride | 5-Chloro-3-thiophenemethanamine HCl | (5-Chlorothiophen-3-yl)methanamine HCl | SCHEMBL355027 | DTXSID607
Specifications & Purity
≥97%
Storage Temp
Room temperature
Shipped In
Normal
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organic nitrogen compounds
Class
Organonitrogen compounds
Subclass
Amines
Intermediate Tree Nodes
Not available
Direct Parent
Aralkylamines
Alternative Parents
Aryl chlorides Thiophenes Heteroaromatic compounds Organochlorides Monoalkylamines Hydrochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aralkylamine - Aryl halide - Aryl chloride - Heteroaromatic compound - Thiophene - Organoheterocyclic compound - Hydrocarbon derivative - Hydrochloride - Primary amine - Organochloride - Organohalogen compound - Primary aliphatic amine - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as aralkylamines. These are alkylamines in which the alkyl group is substituted at one carbon atom by an aromatic hydrocarbyl group.
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
IUPAC Name
(5-chlorothiophen-3-yl)methanamine;hydrochloride
INCHI
InChI=1S/C5H6ClNS.ClH/c6-5-1-4(2-7)3-8-5;/h1,3H,2,7H2;1H
InChIKey
SBYZUYHIUFMANA-UHFFFAOYSA-N
Smiles
C1=C(SC=C1CN)Cl.Cl
Isomeric SMILES
C1=C(SC=C1CN)Cl.Cl
PubChem CID
57415853
Molecular Weight
184.087
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Molecular Weight
184.090 g/mol
XLogP3
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
1
Exact Mass
182.968 Da
Monoisotopic Mass
182.968 Da
Topological Polar Surface Area
54.300 Ų
Heavy Atom Count
9
Formal Charge
0
Complexity
78.800
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
2
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