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RefChem:1068934 structure
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RefChem:1068934

TL;DR: RefChem:1068934 (CAS 157596-30-0) is a chemical compound with molecular formula C21H29ClN2O and molecular weight 360.19684 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N-[2-[(Z)-1,2-dihydrocyclopenta[a]naphthalen-3-ylideneamino]oxyethyl]-N-propan-2-ylpropan-2-amine;hydrochloride

Also Known As: 3-(2-(N-1-Methylethyl-2-propylamino)ethoxyimino)-2,3-dihydro-1H-benz(e)indene hydrochloride, 3H-Benz(e)inden-3-one, 1,2-dihydro-, O-(2-(bis(1-methylethyl)amino)ethyl)oxime, monohydrochloride, N-[2-[(Z)-1,2-dihydrocyclopenta[a]naphthalen-3-ylideneamino]oxyethyl]-N-propan-2-ylpropan-2-amine hydrochloride

CAS Number
157596-30-0
Molecular Formula
C21H29ClN2O
Molecular Weight
360.19684 g/mol
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Technical Specifications

Molecular FormulaC21H29ClN2O
Molecular Weight360.19684 g/mol
XLogP5.0473
Topological Polar Surface Area (TPSA)24.8 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors3
Rotatable Bonds6
Exact Mass360.19684 Da
Heavy Atoms25
Complexity424.0
SMILESCC(C)N(CCO/N=C\1/CCC2=C1C=CC3=CC=CC=C23)C(C)C.Cl
InChIKeyRXORLHLSZZLIJR-SVXKRPBISA-N

Chemical Property Profile of RefChem:1068934

XLogP
5.0473
TPSA (Topological Polar Surface Area)
24.8
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
3
Rotatable Bonds
6
Heavy Atoms
25
Complexity
424.0
Exact Mass
360.19684
Monoisotopic Mass
360.19684
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of RefChem:1068934

The XLogP value of 5.0473 indicates that RefChem:1068934 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.8 Ų, RefChem:1068934 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1068934 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of RefChem:1068934?

The CAS number of RefChem:1068934 is 157596-30-0.

What is the molecular formula of RefChem:1068934?

The molecular formula of RefChem:1068934 is C21H29ClN2O.

What is the molecular weight of RefChem:1068934?

The molecular weight of RefChem:1068934 is 360.19684 g/mol.

Where can I buy RefChem:1068934?

You can request a quote for RefChem:1068934 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for RefChem:1068934?

Yes, CoreyChem provides custom synthesis services for RefChem:1068934 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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