200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 89444-94-0
89444-94-0 | 1-Butanone, 1,3-bis(2,4,6-trimethoxyphenyl)-
CAS No: 89444-94-0 Catalog No: AG0044IV MDL No:
Product Description
Catalog Number:
AG0044IV
Chemical Name:
1-Butanone, 1,3-bis(2,4,6-trimethoxyphenyl)-
CAS Number:
89444-94-0
Molecular Formula:
C22H28O7
Molecular Weight:
404.4535
IUPAC Name:
1,3-bis(2,4,6-trimethoxyphenyl)butan-1-one
InChI:
InChI=1S/C22H28O7/c1-13(21-17(26-4)9-14(24-2)10-18(21)27-5)8-16(23)22-19(28-6)11-15(25-3)12-20(22)29-7/h9-13H,8H2,1-7H3
InChI Key:
DICMVECOVGOJHA-UHFFFAOYSA-N
SMILES:
COc1cc(OC)c(c(c1)OC)C(CC(=O)c1c(OC)cc(cc1OC)OC)C
Properties
Complexity:
472
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
404.184g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
404.459g/mol
Monoisotopic Mass:
404.184g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
72.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.