200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 87698-36-0
87698-36-0 | 1H-Indene-1,3(2H)-dione, 2-(3-ethoxy-2-phenyl-2-propenyl)-2-nitro-
CAS No: 87698-36-0 Catalog No: AG004GLM MDL No:
Product Description
Catalog Number:
AG004GLM
Chemical Name:
1H-Indene-1,3(2H)-dione, 2-(3-ethoxy-2-phenyl-2-propenyl)-2-nitro-
CAS Number:
87698-36-0
Molecular Formula:
C20H17NO5
Molecular Weight:
351.3527
IUPAC Name:
2-(3-ethoxy-2-phenylprop-2-enyl)-2-nitroindene-1,3-dione
InChI:
InChI=1S/C20H17NO5/c1-2-26-13-15(14-8-4-3-5-9-14)12-20(21(24)25)18(22)16-10-6-7-11-17(16)19(20)23/h3-11,13H,2,12H2,1H3
InChI Key:
HWZZMRBSWHRXQR-UHFFFAOYSA-N
SMILES:
CCOC=C(c1ccccc1)CC1([N+](=O)[O-])C(=O)c2c(C1=O)cccc2
Properties
Complexity:
576
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
351.111g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
351.358g/mol
Monoisotopic Mass:
351.111g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
89.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.