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RefChem:305559 structure
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RefChem:305559

TL;DR: RefChem:305559 (CAS 73927-66-9) is a chemical compound with molecular formula C21H26ClN and molecular weight 327.17538 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

dimethyl-[4-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenylidene)butan-2-yl]azanium chloride

Also Known As: 5H-Dibenzo(a,d)cycloheptene, 10,11-dihydro-5-(3-dimethylaminobutylidene)-, hydrochloride, 5-(gamma-Dimethylaminobutylidene) dibenzo(a,d)cyclohepta(1,4)diene hydrochloride, 10,11-Dihydro-5-(3-dimethylaminobutylidene)-5H-dibenzo(a,d)cycloheptene hydrochloride, 2-Butanamine, 4-(10,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-ylidene)-N,N-dimethyl-, hydrochloride

CAS Number
73927-66-9
Molecular Formula
C21H26ClN
Molecular Weight
327.17538 g/mol
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Technical Specifications

Molecular FormulaC21H26ClN
Molecular Weight327.17538 g/mol
XLogP0.14
Topological Polar Surface Area (TPSA)4.4 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors1
Rotatable Bonds3
Exact Mass327.17538 Da
Heavy Atoms23
Complexity357.0
SMILESCC(CC=C1C2=CC=CC=C2CCC3=CC=CC=C31)[NH+](C)C.[Cl-]
InChIKeyIPWHJVIMIXDXDX-UHFFFAOYSA-N

Chemical Property Profile of RefChem:305559

XLogP
0.14
TPSA (Topological Polar Surface Area)
4.4
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
1
Rotatable Bonds
3
Heavy Atoms
23
Complexity
357.0
Exact Mass
327.17538
Monoisotopic Mass
327.17538
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:305559

The XLogP value of 0.14 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:305559. With a topological polar surface area (TPSA) of 4.4 Ų, RefChem:305559 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:305559 has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of RefChem:305559?

The CAS number of RefChem:305559 is 73927-66-9.

What is the molecular formula of RefChem:305559?

The molecular formula of RefChem:305559 is C21H26ClN.

What is the molecular weight of RefChem:305559?

The molecular weight of RefChem:305559 is 327.17538 g/mol.

Where can I buy RefChem:305559?

You can request a quote for RefChem:305559 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for RefChem:305559?

Yes, CoreyChem provides custom synthesis services for RefChem:305559 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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