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1‐(3‐fluoro‐4‐methoxyphenyl)cyclopropan‐1‐amine hydrochloride - 97%, high purity , CAS No.1860028-22-3
Discover 1‐(3‐fluoro‐4‐methoxyphenyl)cyclopropan‐1‐amine hydrochloride by Aladdin Scientific in 97% for only $336.90. Available - in Ligands at Aladdin Scientific. Tags: .
Basic Description
Synonyms
1860028-22-3 | 1-(3-fluoro-4-methoxyphenyl)cyclopropanamine hydrochloride | 1260852-84-3 | 1-(3-FLUORO-4-METHOXYPHENYL)CYCLOPROPANAMINE HCL | 1-(3-fluoro-4-methoxyphenyl)cyclopropan-1-amine;hydrochloride | MFCD22631474 | 1-(3-fluoro-4-methoxyphenyl)cyclopropan-1-amin
Specifications & Purity
≥97%
Storage Temp
Room temperature
Shipped In
Normal
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenol ethers
Subclass
Anisoles
Intermediate Tree Nodes
Not available
Direct Parent
Anisoles
Alternative Parents
Phenoxy compounds Methoxybenzenes Fluorobenzenes Aralkylamines Alkyl aryl ethers Aryl fluorides Organofluorides Monoalkylamines Hydrochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenoxy compound - Anisole - Methoxybenzene - Alkyl aryl ether - Fluorobenzene - Halobenzene - Aralkylamine - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Ether - Organofluoride - Organohalogen compound - Primary aliphatic amine - Hydrochloride - Hydrocarbon derivative - Organic oxygen compound - Amine - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Primary amine - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as anisoles. These are organic compounds containing a methoxybenzene or a derivative thereof.
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
1-(3-fluoro-4-methoxyphenyl)cyclopropan-1-amine;hydrochloride
INCHI
InChI=1S/C10H12FNO.ClH/c1-13-9-3-2-7(6-8(9)11)10(12)4-5-10;/h2-3,6H,4-5,12H2,1H3;1H
InChIKey
LVWJHCRKPFDRBB-UHFFFAOYSA-N
Smiles
COC1=C(C=C(C=C1)C2(CC2)N)F.Cl
Isomeric SMILES
COC1=C(C=C(C=C1)C2(CC2)N)F.Cl
PubChem CID
71744316
Molecular Weight
217.668
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Molecular Weight
217.670 g/mol
XLogP3
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
2
Exact Mass
217.067 Da
Monoisotopic Mass
217.067 Da
Topological Polar Surface Area
35.300 Ų
Heavy Atom Count
14
Formal Charge
0
Complexity
193.000
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
2
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