1,3-Diaminocyclohexane, cis-
TL;DR: 1,3-Diaminocyclohexane, cis- (CAS 1821735-98-1) is a chemical compound with molecular formula C6H14N2 and molecular weight 114.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cis-(1S,3R)-cyclohexane-1,3-diamine
Also Known As: cis-1,3-Cyclohexanediamine, cis-1,3-Diaminocyclohexane, cis-cyclohexane-1,3-diamine, (1R,3S)-cyclohexane-1,3-diamine, 1,3-Cyclohexanediamine, cis-
| Molecular Formula | C6H14N2 |
|---|---|
| Molecular Weight | 114.12 g/mol |
| LogP | 0.215 |
| Topological Polar Surface Area | 52.04 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 114.1157 |
| Heavy Atoms | 8 |
| Complexity | 64.92879 |
Chemical Identifiers
| CAS Number | 1821735-98-1 |
|---|---|
| SMILES | C1C[C@H](C[C@H](C1)N)N |
Product Overview
1,3-Diaminocyclohexane, cis- (CAS 1821735-98-1), with molecular formula C6H14N2 and molecular weight 114.12 g/mol. IUPAC: cis-(1S,3R)-cyclohexane-1,3-diamine.
Chemical Property Profile of 1,3-Diaminocyclohexane, cis-
Property Insights of 1,3-Diaminocyclohexane, cis-
The XLogP value of 0.215 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Diaminocyclohexane, cis-. With a topological polar surface area (TPSA) of 52.04 Ų, 1,3-Diaminocyclohexane, cis- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Diaminocyclohexane, cis- has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,3-Diaminocyclohexane, cis-?
The CAS number of 1,3-Diaminocyclohexane, cis- is 1821735-98-1.
What is the molecular formula of 1,3-Diaminocyclohexane, cis-?
The molecular formula of 1,3-Diaminocyclohexane, cis- is C6H14N2.
What is the molecular weight of 1,3-Diaminocyclohexane, cis-?
The molecular weight of 1,3-Diaminocyclohexane, cis- is 114.12 g/mol.
Where can I buy 1,3-Diaminocyclohexane, cis-?
You can request a quote for 1,3-Diaminocyclohexane, cis- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Diaminocyclohexane, cis-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Diaminocyclohexane, cis- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.