200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 119800-11-2
119800-11-2 | Pyrimidine, 2-[4'-(hexyloxy)[1,1'-biphenyl]-4-yl]-5-octyl-
CAS No: 119800-11-2 Catalog No: AG000POG MDL No:
Product Description
Catalog Number:
AG000POG
Chemical Name:
Pyrimidine, 2-[4'-(hexyloxy)[1,1'-biphenyl]-4-yl]-5-octyl-
CAS Number:
119800-11-2
Molecular Formula:
C30H40N2O
Molecular Weight:
444.6514
IUPAC Name:
2-[4-(4-hexoxyphenyl)phenyl]-5-octylpyrimidine
InChI:
InChI=1S/C30H40N2O/c1-3-5-7-9-10-11-13-25-23-31-30(32-24-25)28-16-14-26(15-17-28)27-18-20-29(21-19-27)33-22-12-8-6-4-2/h14-21,23-24H,3-13,22H2,1-2H3
InChI Key:
UXAQOTPYCONOKE-UHFFFAOYSA-N
SMILES:
CCCCCCCCc1cnc(nc1)c1ccc(cc1)c1ccc(cc1)OCCCCCC
Properties
Complexity:
460
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
444.314g/mol
Formal Charge:
0
Heavy Atom Count:
33
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
444.663g/mol
Monoisotopic Mass:
444.314g/mol
Rotatable Bond Count:
15
Topological Polar Surface Area:
35A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
9.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.