200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 1713-20-8
1713-20-8 | (2E)-3-(3,4-dimethoxyphenyl)-1-(4-nitrophenyl)prop-2-en-1-one
CAS No: 1713-20-8 Catalog No: AG00JU1F MDL No:MFCD00024740
Product Description
Catalog Number:
AG00JU1F
Chemical Name:
(2E)-3-(3,4-dimethoxyphenyl)-1-(4-nitrophenyl)prop-2-en-1-one
CAS Number:
1713-20-8
Molecular Formula:
C17H15NO5
Molecular Weight:
313.3047
MDL Number:
MFCD00024740
IUPAC Name:
3-(3,4-dimethoxyphenyl)-1-(4-nitrophenyl)prop-2-en-1-one
InChI:
InChI=1S/C17H15NO5/c1-22-16-10-4-12(11-17(16)23-2)3-9-15(19)13-5-7-14(8-6-13)18(20)21/h3-11H,1-2H3
InChI Key:
VPAWFBROEHJSGP-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1OC)/C=C/C(=O)c1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
437
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
313.095g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
313.309g/mol
Monoisotopic Mass:
313.095g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
81.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.