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(5-chlorothiophen-3-yl)methanol - 97%, high purity , CAS No.73919-87-6
Discover (5-chlorothiophen-3-yl)methanol by Aladdin Scientific in 97% for only $227.90. Available - in Ligands at Aladdin Scientific. Tags: .
Basic Description
Synonyms
(5-CHLOROTHIOPHEN-3-YL)METHANOL | 73919-87-6 | 5-CHLOROTHIOPHENE-3-METHANOL | 3-Thiophenemethanol, 5-chloro- | (5-chloro-3-thienyl)methanol | SCHEMBL1196640 | DTXSID30608851 | RJCDMSXITBOXRL-UHFFFAOYSA-N | YCA91987 | MFCD13659394 | AKOS016002231 | PB13604 | AS-33768 | CS-0053150 | F
Specifications & Purity
≥97%
Storage Temp
Room temperature
Shipped In
Normal
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organohalogen compounds
Class
Aryl halides
Subclass
Aryl chlorides
Intermediate Tree Nodes
Not available
Direct Parent
Aryl chlorides
Alternative Parents
Thiophenes Heteroaromatic compounds Primary alcohols Organochlorides Hydrocarbon derivatives Aromatic alcohols
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aryl chloride - Heteroaromatic compound - Thiophene - Organoheterocyclic compound - Organic oxygen compound - Hydrocarbon derivative - Aromatic alcohol - Primary alcohol - Organooxygen compound - Organochloride - Alcohol - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as aryl chlorides. These are organic compounds containing the acyl chloride functional 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)methanol
INCHI
InChI=1S/C5H5ClOS/c6-5-1-4(2-7)3-8-5/h1,3,7H,2H2
InChIKey
RJCDMSXITBOXRL-UHFFFAOYSA-N
Smiles
C1=C(SC=C1CO)Cl
Isomeric SMILES
C1=C(SC=C1CO)Cl
Molecular Weight
148.6
Reaxy-Rn
14223719
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=14223719&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Molecular Weight
148.610 g/mol
XLogP3
1.700
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
1
Exact Mass
147.975 Da
Monoisotopic Mass
147.975 Da
Topological Polar Surface Area
48.500 Ų
Heavy Atom Count
8
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
1
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