200,000+ products from a single source!
sales@angenechem.com
Home > Pyridines > 188985-27-5
188985-27-5 | 1H-Pyrrolo[3,2-b]pyridinium, 6-hydroxy-5-methyl-1,4-dipentyl-
CAS No: 188985-27-5 Catalog No: AG002HMV MDL No:
Product Description
Catalog Number:
AG002HMV
Chemical Name:
1H-Pyrrolo[3,2-b]pyridinium, 6-hydroxy-5-methyl-1,4-dipentyl-
CAS Number:
188985-27-5
Molecular Formula:
C18H31N2O+
Molecular Weight:
291.4515
IUPAC Name:
5-methyl-1,4-dipentyl-1,2-dihydropyrrolo[3,2-b]pyridin-1-ium-6-ol
InChI:
InChI=1S/C18H30N2O/c1-4-6-8-11-19-13-10-16-17(19)14-18(21)15(3)20(16)12-9-7-5-2/h10,14,21H,4-9,11-13H2,1-3H3/p+1
InChI Key:
FKZGRICZHMNFLF-UHFFFAOYSA-O
SMILES:
CCCCC[NH+]1CC=c2c1cc(O)c(n2CCCCC)C
Properties
Complexity:
448
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.244g/mol
Formal Charge:
1
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
291.459g/mol
Monoisotopic Mass:
291.244g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
27.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
Related Products
© 2019 Angene International Limited. All rights Reserved.