200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 88022-52-0
88022-52-0 | 2-Decyn-1-one, 4-methoxy-4-methyl-1-(3-methylphenyl)-
CAS No: 88022-52-0 Catalog No: AG004NO3 MDL No:
Product Description
Catalog Number:
AG004NO3
Chemical Name:
2-Decyn-1-one, 4-methoxy-4-methyl-1-(3-methylphenyl)-
CAS Number:
88022-52-0
Molecular Formula:
C19H26O2
Molecular Weight:
286.4085
IUPAC Name:
4-methoxy-4-methyl-1-(3-methylphenyl)dec-2-yn-1-one
InChI:
InChI=1S/C19H26O2/c1-5-6-7-8-13-19(3,21-4)14-12-18(20)17-11-9-10-16(2)15-17/h9-11,15H,5-8,13H2,1-4H3
InChI Key:
JJEWHNDDWPCUTE-UHFFFAOYSA-N
SMILES:
CCCCCCC(C#CC(=O)c1cccc(c1)C)(OC)C
Properties
Complexity:
387
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.193g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
286.415g/mol
Monoisotopic Mass:
286.193g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.