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5H-Dibenz(b,f)azepine-5-propanamine, N,N,beta-trimethyl-, monohydrochloride structure
Fine Chemical

5H-Dibenz(b,f)azepine-5-propanamine, N,N,beta-trimethyl-, monohydrochloride

TL;DR: 5H-Dibenz(b,f)azepine-5-propanamine, N,N,beta-trimethyl-, monohydrochloride (CAS 1159-80-4) is a chemical compound with molecular formula C20H25ClN2 and molecular weight 328.17062 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-benzo[b][1]benzazepin-11-yl-N,N,2-trimethylpropan-1-amine;hydrochloride

Also Known As: Menthol acetoacetate, N,N,beta-Trimethyl-5H-dibenz(b,f)azepine-5-propanamine monohydrochloride, 5H-Dibenz(b,f)azepine-5-propanamine, N,N,beta-trimethyl-, monohydrochloride, 1-(Methyl-2 dimethylamino-3 propyl)-5 dibenzo(b,f) 5H azepine chlorhydrate [French], 1-(Methyl-2 dimethylamino-3 propyl)-5 dibenzo(b,f) 5H azepine chlorhydrate

CAS Number
1159-80-4
Molecular Formula
C20H25ClN2
Molecular Weight
328.17062 g/mol
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Technical Specifications

Molecular FormulaC20H25ClN2
Molecular Weight328.17062 g/mol
XLogP4.93
Topological Polar Surface Area (TPSA)6.5 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors2
Rotatable Bonds4
Exact Mass328.17062 Da
Heavy Atoms23
Complexity350.0
SMILESCC(CN1C2=CC=CC=C2C=CC3=CC=CC=C31)CN(C)C.Cl
InChIKeyXDWNTULJQAJLQV-UHFFFAOYSA-N

Chemical Property Profile of 5H-Dibenz(b,f)azepine-5-propanamine, N,N,beta-trimethyl-, monohydrochloride

XLogP
4.93
TPSA (Topological Polar Surface Area)
6.5
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
Rotatable Bonds
4
Heavy Atoms
23
Complexity
350.0
Exact Mass
328.17062
Monoisotopic Mass
328.17062
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 5H-Dibenz(b,f)azepine-5-propanamine, N,N,beta-trimethyl-, monohydrochloride

The XLogP value of 4.93 indicates that 5H-Dibenz(b,f)azepine-5-propanamine, N,N,beta-trimethyl-, monohydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 6.5 Ų, 5H-Dibenz(b,f)azepine-5-propanamine, N,N,beta-trimethyl-, monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5H-Dibenz(b,f)azepine-5-propanamine, N,N,beta-trimethyl-, monohydrochloride has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 5H-Dibenz(b,f)azepine-5-propanamine, N,N,beta-trimethyl-, monohydrochloride?

The CAS number of 5H-Dibenz(b,f)azepine-5-propanamine, N,N,beta-trimethyl-, monohydrochloride is 1159-80-4.

What is the molecular formula of 5H-Dibenz(b,f)azepine-5-propanamine, N,N,beta-trimethyl-, monohydrochloride?

The molecular formula of 5H-Dibenz(b,f)azepine-5-propanamine, N,N,beta-trimethyl-, monohydrochloride is C20H25ClN2.

What is the molecular weight of 5H-Dibenz(b,f)azepine-5-propanamine, N,N,beta-trimethyl-, monohydrochloride?

The molecular weight of 5H-Dibenz(b,f)azepine-5-propanamine, N,N,beta-trimethyl-, monohydrochloride is 328.17062 g/mol.

Where can I buy 5H-Dibenz(b,f)azepine-5-propanamine, N,N,beta-trimethyl-, monohydrochloride?

You can request a quote for 5H-Dibenz(b,f)azepine-5-propanamine, N,N,beta-trimethyl-, monohydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 5H-Dibenz(b,f)azepine-5-propanamine, N,N,beta-trimethyl-, monohydrochloride?

Yes, CoreyChem provides custom synthesis services for 5H-Dibenz(b,f)azepine-5-propanamine, N,N,beta-trimethyl-, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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