1,3-Benzodioxole-5-methanamine, N,N-bis(3,7,11-trimethyl-2,6,10-dodecatrienyl)-
TL;DR: 1,3-Benzodioxole-5-methanamine, N,N-bis(3,7,11-trimethyl-2,6,10-dodecatrienyl)- (CAS 55436-80-1) is a chemical compound with molecular formula C38H57NO2 and molecular weight 559.44 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E,6E)-N-(1,3-benzodioxol-5-ylmethyl)-3,7,11-trimethyl-N-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]dodeca-2,6,10-trien-1-amine
Also Known As: N,N-Bis(3,7,11-trimethyl-2,6,10-dodecatrienyl)-1,3-benzodioxol-5-methanamine, 1,3-Benzodioxole-5-methanamine, N,N-bis(3,7,11-trimethyl-2,6,10-dodecatrienyl)-, (2E,6E)-N-(1,3-benzodioxol-5-ylmethyl)-3,7,11-trimethyl-N-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]dodeca-2,6,10-trien-1-amine, RefChem:1052713, BRN 1443715
| Molecular Formula | C38H57NO2 |
|---|---|
| Molecular Weight | 559.44 g/mol |
| LogP | 11.0557 |
| Topological Polar Surface Area | 21.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 18 |
| Exact Mass | 559.4389 |
| Heavy Atoms | 41 |
| Complexity | 1060.9309 |
Chemical Identifiers
| CAS Number | 55436-80-1 |
|---|---|
| SMILES | CC(=CCC/C(=C/CC/C(=C/CN(CC1=CC2=C(OCO2)C=C1)C/C=C(/CC/C=C(/CCC=C(C)C)\C)\C)/C)/C)C |
Product Overview
1,3-Benzodioxole-5-methanamine, N,N-bis(3,7,11-trimethyl-2,6,10-dodecatrienyl)- (CAS 55436-80-1), with molecular formula C38H57NO2 and molecular weight 559.44 g/mol. IUPAC: (2E,6E)-N-(1,3-benzodioxol-5-ylmethyl)-3,7,11-trimethyl-N-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]dodeca-2,6,10-trien-1-amine.
Chemical Property Profile of 1,3-Benzodioxole-5-methanamine, N,N-bis(3,7,11-trimethyl-2,6,10-dodecatrienyl)-
Property Insights of 1,3-Benzodioxole-5-methanamine, N,N-bis(3,7,11-trimethyl-2,6,10-dodecatrienyl)-
The XLogP value of 11.0557 indicates that 1,3-Benzodioxole-5-methanamine, N,N-bis(3,7,11-trimethyl-2,6,10-dodecatrienyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.7 Ų, 1,3-Benzodioxole-5-methanamine, N,N-bis(3,7,11-trimethyl-2,6,10-dodecatrienyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Benzodioxole-5-methanamine, N,N-bis(3,7,11-trimethyl-2,6,10-dodecatrienyl)- has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,3-Benzodioxole-5-methanamine, N,N-bis(3,7,11-trimethyl-2,6,10-dodecatrienyl)-?
The CAS number of 1,3-Benzodioxole-5-methanamine, N,N-bis(3,7,11-trimethyl-2,6,10-dodecatrienyl)- is 55436-80-1.
What is the molecular formula of 1,3-Benzodioxole-5-methanamine, N,N-bis(3,7,11-trimethyl-2,6,10-dodecatrienyl)-?
The molecular formula of 1,3-Benzodioxole-5-methanamine, N,N-bis(3,7,11-trimethyl-2,6,10-dodecatrienyl)- is C38H57NO2.
What is the molecular weight of 1,3-Benzodioxole-5-methanamine, N,N-bis(3,7,11-trimethyl-2,6,10-dodecatrienyl)-?
The molecular weight of 1,3-Benzodioxole-5-methanamine, N,N-bis(3,7,11-trimethyl-2,6,10-dodecatrienyl)- is 559.44 g/mol.
Where can I buy 1,3-Benzodioxole-5-methanamine, N,N-bis(3,7,11-trimethyl-2,6,10-dodecatrienyl)-?
You can request a quote for 1,3-Benzodioxole-5-methanamine, N,N-bis(3,7,11-trimethyl-2,6,10-dodecatrienyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Benzodioxole-5-methanamine, N,N-bis(3,7,11-trimethyl-2,6,10-dodecatrienyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Benzodioxole-5-methanamine, N,N-bis(3,7,11-trimethyl-2,6,10-dodecatrienyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.