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(2S,3S)-1-benzhydryl-2-methyl-azetidin-3-amine - 97%, high purity , CAS No.164906-71-2

COA

Grade & Purity:

≥97%

Cas Number: 164906-71-2
Molecular Weight: 252.35
PubChem CID: 10037872

In stock

Item Number

B630134

Grouped product items
SKU	Size	Availability	Price
B630134-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$482.90
B630134-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,413.90
B630134-10g	10g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$2,241.90

Basic Description

Synonyms	(2S,3S)-1-benzhydryl-2-methyl-azetidin-3-amine \| 164906-71-2 \| (2S,3S)-1-benzhydryl-2-methylazetidin-3-amine \| SCHEMBL9363615 \| MFCD31705181 \| BS-43623 \| P20068
Specifications & Purity	≥97%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

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

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Diphenylmethanes
Intermediate Tree Nodes	Not available
Direct Parent	Diphenylmethanes
Alternative Parents	Aralkylamines Trialkylamines Azetidines Azacyclic compounds Monoalkylamines Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Diphenylmethane - Aralkylamine - Tertiary aliphatic amine - Tertiary amine - Azetidine - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Primary aliphatic amine - Amine - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as diphenylmethanes. These are compounds containing a diphenylmethane moiety, which consists of a methane wherein two hydrogen atoms are replaced by two phenyl 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	(2S,3S)-1-benzhydryl-2-methylazetidin-3-amine
INCHI	InChI=1S/C17H20N2/c1-13-16(18)12-19(13)17(14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-11,13,16-17H,12,18H2,1H3/t13-,16-/m0/s1
InChIKey	CJCQBRZYAQTEOO-BBRMVZONSA-N
Smiles	CC1C(CN1C(C2=CC=CC=C2)C3=CC=CC=C3)N
Isomeric SMILES	C[C@H]1[C@H](CN1C(C2=CC=CC=C2)C3=CC=CC=C3)N
PubChem CID	10037872
Molecular Weight	252.35

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	252.350 g/mol
XLogP3	2.800
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	252.163 Da
Monoisotopic Mass	252.163 Da
Topological Polar Surface Area	29.300 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	261.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
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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