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((S)-1-((S)-1-Phenylethyl)pyrrolidin-3-yl)methanol - ≥95%, high purity , CAS No.173724-95-3

COA

Grade & Purity:

≥95%

Cas Number: 173724-95-3
Molecular Weight: 205.3
MDL number: MFCD15526584
PubChem CID: 11084986

In stock

Item Number

P770096

Grouped product items
SKU	Size	Availability	Price	Qty
P770096-100mg	100mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$49.90
P770096-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$109.90

Basic Description

Specifications & Purity	≥95%
Storage Temp	Room temperature,Desiccated
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic nitrogen compounds
  - Class Organonitrogen compounds
    - Subclass Amines

Kingdom	Organic compounds
Superclass	Organic nitrogen compounds
Class	Organonitrogen compounds
Subclass	Amines
Intermediate Tree Nodes	Not available
Direct Parent	Aralkylamines
Alternative Parents	N-alkylpyrrolidines Benzene and substituted derivatives 1,3-aminoalcohols Trialkylamines Azacyclic compounds Primary alcohols Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Aralkylamine - Monocyclic benzene moiety - N-alkylpyrrolidine - Benzenoid - 1,3-aminoalcohol - Pyrrolidine - Tertiary amine - Tertiary aliphatic amine - Azacycle - Organoheterocyclic compound - Organic oxygen compound - Primary alcohol - Organooxygen compound - Hydrocarbon derivative - Alcohol - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as aralkylamines. These are alkylamines in which the alkyl group is substituted at one carbon atom by an aromatic hydrocarbyl group.
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	[(3S)-1-[(1S)-1-phenylethyl]pyrrolidin-3-yl]methanol
INCHI	InChI=1S/C13H19NO/c1-11(13-5-3-2-4-6-13)14-8-7-12(9-14)10-15/h2-6,11-12,15H,7-10H2,1H3/t11-,12-/m0/s1
InChIKey	RQTYGPRJDFTUGU-RYUDHWBXSA-N
Smiles	CC(C1=CC=CC=C1)N2CCC(C2)CO
Isomeric SMILES	C[C@@H](C1=CC=CC=C1)N2CC[C@@H](C2)CO
PubChem CID	11084986
Molecular Weight	205.3

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	205.300 g/mol
XLogP3	1.900
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	205.147 Da
Monoisotopic Mass	205.147 Da
Topological Polar Surface Area	23.500 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	189.000
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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