200,000+ products from a single source!
sales@angenechem.com
311-09-1 | Benzenemethanaminium, N,N'-[(3,6-dioxo-1,4-cyclohexadiene-1,4-diyl)bis(imino-3,1-propanediyl)]bis[N,N-diethyl-, chloride (1:2)
CAS No: 311-09-1 Catalog No: AG003249 MDL No:
Product Description
Catalog Number:
AG003249
Chemical Name:
Benzenemethanaminium, N,N'-[(3,6-dioxo-1,4-cyclohexadiene-1,4-diyl)bis(imino-3,1-propanediyl)]bis[N,N-diethyl-, chloride (1:2)
CAS Number:
311-09-1
Molecular Formula:
C34H50Cl2N4O2
Molecular Weight:
617.6924
IUPAC Name:
benzyl-[3-[[4-[3-[benzyl(diethyl)azaniumyl]propylamino]-3,6-dioxocyclohexa-1,4-dien-1-yl]amino]propyl]-diethylazanium;dichloride
InChI:
InChI=1S/C34H48N4O2.2ClH/c1-5-37(6-2,27-29-17-11-9-12-18-29)23-15-21-35-31-25-34(40)32(26-33(31)39)36-22-16-24-38(7-3,8-4)28-30-19-13-10-14-20-30;;/h9-14,17-20,25-26H,5-8,15-16,21-24,27-28H2,1-4H3;2*1H
InChI Key:
WQRJZLXQCYZJEU-UHFFFAOYSA-N
SMILES:
CC[N+](Cc1ccccc1)(CCCNC1=CC(=O)C(=CC1=O)NCCC[N+](Cc1ccccc1)(CC)CC)CC.[Cl-].[Cl-]
UNII:
O6HVT48T15
Properties
Complexity:
774
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
616.331g/mol
Formal Charge:
0
Heavy Atom Count:
42
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
617.7g/mol
Monoisotopic Mass:
616.331g/mol
Rotatable Bond Count:
18
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
| Title | Journal |
|---|---|
| [Preparation of a novel graphite electrode and its effect on phenol degradation]. | Huan jing ke xue= Huanjing kexue 20090515 |
| Stimulation of salivary secretion in vivo by CFTR potentiators in Cftr+/+ and Cftr-/- mice. | Journal of cystic fibrosis : official journal of the European Cystic Fibrosis Society 20080301 |
| Neuronal control of the cardiac responses to osmotic stress in the gastropod limpet Patella caerulea. | Journal of experimental zoology. Part A, Comparative experimental biology 20060601 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.