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1′-methyl-3,4-dihydrospiro[chromene-2,4′-piperidin]-4-amine hydrochloride - 10mM in DMSO, high purity , CAS No.70505-90-7
Basic Description
Synonyms
70505-90-7 | 1'-Methylspiro[chroman-2,4'-piperidin]-4-amine hydrochloride | 1'-methyl-3,4-dihydrospiro[chromene-2,4'-piperidin]-4-amine hydrochloride | 1193389-01-3 | 1'-Methylspiro[chromane-2,4'-piperidin]-4-amine hydrochloride | 1'-methyl-3,4-dihydrospiro[1-benzo
Specifications & Purity
10mM in DMSO
Storage Temp
Store at -80°C
Shipped In
Dry ice packs + Cold packs
This product requires cold chain shipping. Ground and other economy services are not available.
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzopyrans
Subclass
1-benzopyrans
Intermediate Tree Nodes
Not available
Direct Parent
1-benzopyrans
Alternative Parents
Aralkylamines Alkyl aryl ethers Piperidines Benzenoids Trialkylamines Oxacyclic compounds Azacyclic compounds Monoalkylamines Hydrochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-benzopyran - Alkyl aryl ether - Aralkylamine - Piperidine - Benzenoid - Tertiary amine - Tertiary aliphatic amine - Ether - Oxacycle - Azacycle - Hydrocarbon derivative - Primary amine - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Organic nitrogen compound - Amine - Hydrochloride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1-benzopyrans. These are organic aromatic compounds that 1-benzopyran, a bicyclic compound made up of a benzene ring fused to a pyran, so that the oxygen atom is at the 1-position.
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'-methylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine;hydrochloride
INCHI
InChI=1S/C14H20N2O.ClH/c1-16-8-6-14(7-9-16)10-12(15)11-4-2-3-5-13(11)17-14;/h2-5,12H,6-10,15H2,1H3;1H
InChIKey
NNVNAJGCZFCILW-UHFFFAOYSA-N
Smiles
CN1CCC2(CC1)CC(C3=CC=CC=C3O2)N.Cl
Isomeric SMILES
CN1CCC2(CC1)CC(C3=CC=CC=C3O2)N.Cl
PubChem CID
43810428
Molecular Weight
268.782
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Molecular Weight
268.780 g/mol
XLogP3
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
0
Exact Mass
268.134 Da
Monoisotopic Mass
268.134 Da
Topological Polar Surface Area
38.500 Ų
Heavy Atom Count
18
Formal Charge
0
Complexity
273.000
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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