200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 78916-50-4
78916-50-4 | Benzene, 1,3-dimethoxy-5-(2-phenylethyl)-
CAS No: 78916-50-4 Catalog No: AG0054KR MDL No:
Product Description
Catalog Number:
AG0054KR
Chemical Name:
Benzene, 1,3-dimethoxy-5-(2-phenylethyl)-
CAS Number:
78916-50-4
Molecular Formula:
C16H18O2
Molecular Weight:
242.3129
IUPAC Name:
1,3-dimethoxy-5-(2-phenylethyl)benzene
InChI:
InChI=1S/C16H18O2/c1-17-15-10-14(11-16(12-15)18-2)9-8-13-6-4-3-5-7-13/h3-7,10-12H,8-9H2,1-2H3
InChI Key:
PBHUJCQHJCTMDJ-UHFFFAOYSA-N
SMILES:
COc1cc(CCc2ccccc2)cc(c1)OC
Properties
Complexity:
211
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.131g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.318g/mol
Monoisotopic Mass:
242.131g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.