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3-[(3,5-dimethoxyphenyl)methyl]azetidine hydrochloride - 97%, high purity , CAS No.1376321-05-9

COA

Grade & Purity:

≥97%

Cas Number: 1376321-05-9
EC Number: 878-260-7
PubChem CID: 71755400

In stock

Item Number

A628729

Grouped product items
SKU	Size	Availability	Price
A628729-100mg	100mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$159.90
A628729-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$254.90
A628729-500mg	500mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$424.90
A628729-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$636.90
A628729-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$3,186.90

Basic Description

Synonyms	PS-18007 \| 1376321-05-9 \| 3-[(3,5-dimethoxyphenyl)methyl]azetidine hydrochloride \| SY135239 \| 3-[(3,5-dimethoxyphenyl)methyl]azetidine;hydrochloride \| BFC32105 \| 3-(3,5-DIMETHOXYBENZYL)AZETIDINE HYDROCHLORIDE \| MFCD22056347 \| F71020 \| EN300-100265 \| 3-[(3
Specifications & Purity	≥97%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Methoxybenzenes

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Methoxybenzenes
Intermediate Tree Nodes	Not available
Direct Parent	Dimethoxybenzenes
Alternative Parents	Phenoxy compounds Anisoles Aralkylamines Alkyl aryl ethers Azetidines Dialkylamines Azacyclic compounds Hydrochlorides Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	M-dimethoxybenzene - Dimethoxybenzene - Phenoxy compound - Anisole - Phenol ether - Alkyl aryl ether - Aralkylamine - Azetidine - Secondary aliphatic amine - Ether - Azacycle - Secondary amine - Organoheterocyclic compound - Organonitrogen compound - Amine - Organic nitrogen compound - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Hydrochloride - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as dimethoxybenzenes. These are organic aromatic compounds containing a monocyclic benzene moiety carrying exactly two methoxy groups.
External Descriptors	Not available
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. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

IUPAC Name	3-[(3,5-dimethoxyphenyl)methyl]azetidine;hydrochloride
INCHI	InChI=1S/C12H17NO2.ClH/c1-14-11-4-9(3-10-7-13-8-10)5-12(6-11)15-2;/h4-6,10,13H,3,7-8H2,1-2H3;1H
InChIKey	YFDVQUDDPYSADO-UHFFFAOYSA-N
Smiles	COC1=CC(=CC(=C1)CC2CNC2)OC.Cl
Isomeric SMILES	COC1=CC(=CC(=C1)CC2CNC2)OC.Cl
Alternate CAS	1376321-05-9
PubChem CID	71755400

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	243.730 g/mol
XLogP3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Exact Mass	243.103 Da
Monoisotopic Mass	243.103 Da
Topological Polar Surface Area	30.500 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	182.000
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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