200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 89023-08-5
89023-08-5 | 2-Propenoic acid, 3-[4-(decyloxy)phenyl]-, 4-nitrophenyl ester, (E)-
CAS No: 89023-08-5 Catalog No: AG0044CM MDL No:
Product Description
Catalog Number:
AG0044CM
Chemical Name:
2-Propenoic acid, 3-[4-(decyloxy)phenyl]-, 4-nitrophenyl ester, (E)-
CAS Number:
89023-08-5
Molecular Formula:
C25H31NO5
Molecular Weight:
425.5173
IUPAC Name:
(4-nitrophenyl) 3-(4-decoxyphenyl)prop-2-enoate
InChI:
InChI=1S/C25H31NO5/c1-2-3-4-5-6-7-8-9-20-30-23-15-10-21(11-16-23)12-19-25(27)31-24-17-13-22(14-18-24)26(28)29/h10-19H,2-9,20H2,1H3
InChI Key:
VVTRPAHCLLXCIK-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCOc1ccc(cc1)/C=C/C(=O)Oc1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
529
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
425.22g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
425.525g/mol
Monoisotopic Mass:
425.22g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
81.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
8.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.