200,000+ products from a single source!
sales@angenechem.com
827027-82-7 | 1-Butanaminium, N,N,N-trimethyl-4-[[4-(1-nonynyl)benzoyl]oxy]-, iodide
CAS No: 827027-82-7 Catalog No: AG004WFP MDL No:
Product Description
Catalog Number:
AG004WFP
Chemical Name:
1-Butanaminium, N,N,N-trimethyl-4-[[4-(1-nonynyl)benzoyl]oxy]-, iodide
CAS Number:
827027-82-7
Molecular Formula:
C23H36INO2
Molecular Weight:
485.4419
IUPAC Name:
trimethyl-[4-(4-non-1-ynylbenzoyl)oxybutyl]azanium;iodide
InChI:
InChI=1S/C23H36NO2.HI/c1-5-6-7-8-9-10-11-14-21-15-17-22(18-16-21)23(25)26-20-13-12-19-24(2,3)4;/h15-18H,5-10,12-13,19-20H2,1-4H3;1H/q+1;/p-1
InChI Key:
UJYFNJJRJAPIBK-UHFFFAOYSA-M
SMILES:
CCCCCCCC#Cc1ccc(cc1)C(=O)OCCCC[N+](C)(C)C.[I-]
Properties
Complexity:
444
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
485.179g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
485.45g/mol
Monoisotopic Mass:
485.179g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.