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(2,2-difluorocyclobutyl)methanamine hydrochloride - 97%, high purity , CAS No.2055839-95-5
Discover (2,2-difluorocyclobutyl)methanamine hydrochloride by Aladdin Scientific in 97% for only $12,841.90. Available - in Ligands at Aladdin Scientific. Tags: .
Basic Description
Synonyms
(2,2-difluorocyclobutyl)methanamine hydrochloride | 2055839-95-5 | (2,2-Difluorocyclobutyl)methanamine HCl | (2,2-difluorocyclobutyl)methanamine;hydrochloride | 1-(2,2-DIFLUOROCYCLOBUTYL)METHANAMINE HYDROCHLORIDE | YBIVAKBKIJCQGS-UHFFFAOYSA-N | MFCD30530422 | AKOS03062
Specifications & Purity
≥97%
Storage Temp
Room temperature
Shipped In
Normal
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organohalogen compounds
Class
Organofluorides
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Organofluorides
Alternative Parents
Organic chloride salts Monoalkylamines Hydrochlorides Hydrocarbon derivatives Alkyl fluorides Organic anions
Molecular Framework
Aliphatic homomonocyclic compounds
Substituents
Organic nitrogen compound - Hydrocarbon derivative - Organic chloride salt - Hydrochloride - Primary amine - Organonitrogen compound - Organofluoride - Primary aliphatic amine - Amine - Alkyl halide - Alkyl fluoride - Organic anion - Aliphatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as organofluorides. These are compounds containing a chemical bond between a carbon atom and a fluorine atom.
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
(2,2-difluorocyclobutyl)methanamine;hydrochloride
INCHI
InChI=1S/C5H9F2N.ClH/c6-5(7)2-1-4(5)3-8;/h4H,1-3,8H2;1H
InChIKey
YBIVAKBKIJCQGS-UHFFFAOYSA-N
Smiles
C1CC(C1CN)(F)F.Cl
Isomeric SMILES
C1CC(C1CN)(F)F.Cl
PubChem CID
127263313
Molecular Weight
157.59
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Molecular Weight
157.590 g/mol
XLogP3
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
1
Exact Mass
157.047 Da
Monoisotopic Mass
157.047 Da
Topological Polar Surface Area
26.000 Ų
Heavy Atom Count
9
Formal Charge
0
Complexity
92.400
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
1
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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