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10,11-Dihydrodibenzo[b,f]oxepine-1,3-diamine dihydrochloride structure
Fine Chemical

10,11-Dihydrodibenzo[b,f]oxepine-1,3-diamine dihydrochloride

TL;DR: 10,11-Dihydrodibenzo[b,f]oxepine-1,3-diamine dihydrochloride (CAS 1051369-20-0) is a chemical compound with molecular formula C14H16Cl2N2O and molecular weight 298.06396 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

5,6-dihydrobenzo[b][1]benzoxepine-2,4-diamine;dihydrochloride

Also Known As: 10,11-dihydrodibenzo[b,f]oxepine-1,3-diamine dihydrochloride, 5,6-dihydrobenzo[b][1]benzoxepine-2,4-diamine;dihydrochloride, 10,11-Dihydrodibenzob,foxepine-1,3-diamine dihydrochloride, 10,11-dihydrodibenzo[b,f]oxepine-1,3-diaminedihydrochloride, 5,6-dihydrobenzo[b][1]benzoxepine-2,4-diamine dihydrochloride

CAS Number
1051369-20-0
Molecular Formula
C14H16Cl2N2O
Molecular Weight
298.06396 g/mol
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Technical Specifications

Molecular FormulaC14H16Cl2N2O
Molecular Weight298.06396 g/mol
XLogP3.5855
Topological Polar Surface Area (TPSA)61.3 Ų
Hydrogen Bond Donors4
Hydrogen Bond Acceptors3
Rotatable Bonds0
Exact Mass298.06396 Da
Heavy Atoms19
Complexity271.0
SMILESC1CC2=C(C=C(C=C2OC3=CC=CC=C31)N)N.Cl.Cl
InChIKeyGPELOEZZAOHIKD-UHFFFAOYSA-N

Chemical Property Profile of 10,11-Dihydrodibenzo[b,f]oxepine-1,3-diamine dihydrochloride

XLogP
3.5855
TPSA (Topological Polar Surface Area)
61.3
Hydrogen Bond Donors
4
Hydrogen Bond Acceptors
3
Rotatable Bonds
0
Heavy Atoms
19
Complexity
271.0
Exact Mass
298.06396
Monoisotopic Mass
298.06396
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 10,11-Dihydrodibenzo[b,f]oxepine-1,3-diamine dihydrochloride

The XLogP value of 3.5855 indicates that 10,11-Dihydrodibenzo[b,f]oxepine-1,3-diamine dihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 10,11-Dihydrodibenzo[b,f]oxepine-1,3-diamine dihydrochloride. Following Lipinski's Rule of Five, 10,11-Dihydrodibenzo[b,f]oxepine-1,3-diamine dihydrochloride has 4 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 10,11-Dihydrodibenzo[b,f]oxepine-1,3-diamine dihydrochloride?

The CAS number of 10,11-Dihydrodibenzo[b,f]oxepine-1,3-diamine dihydrochloride is 1051369-20-0.

What is the molecular formula of 10,11-Dihydrodibenzo[b,f]oxepine-1,3-diamine dihydrochloride?

The molecular formula of 10,11-Dihydrodibenzo[b,f]oxepine-1,3-diamine dihydrochloride is C14H16Cl2N2O.

What is the molecular weight of 10,11-Dihydrodibenzo[b,f]oxepine-1,3-diamine dihydrochloride?

The molecular weight of 10,11-Dihydrodibenzo[b,f]oxepine-1,3-diamine dihydrochloride is 298.06396 g/mol.

Where can I buy 10,11-Dihydrodibenzo[b,f]oxepine-1,3-diamine dihydrochloride?

You can request a quote for 10,11-Dihydrodibenzo[b,f]oxepine-1,3-diamine dihydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 10,11-Dihydrodibenzo[b,f]oxepine-1,3-diamine dihydrochloride?

Yes, CoreyChem provides custom synthesis services for 10,11-Dihydrodibenzo[b,f]oxepine-1,3-diamine dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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