200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 84905-26-0
84905-26-0 | 1-Propene-1,3-dione, 3-(4-methylphenyl)-
CAS No: 84905-26-0 Catalog No: AG004VMA MDL No:
Product Description
Catalog Number:
AG004VMA
Chemical Name:
1-Propene-1,3-dione, 3-(4-methylphenyl)-
CAS Number:
84905-26-0
Molecular Formula:
C10H8O2
Molecular Weight:
160.1693
IUPAC Name:
3-(4-methylphenyl)prop-1-ene-1,3-dione
InChI:
InChI=1S/C10H8O2/c1-8-2-4-9(5-3-8)10(12)6-7-11/h2-6H,1H3
InChI Key:
SWXXHCQCTMBCHZ-UHFFFAOYSA-N
SMILES:
O=C=CC(=O)c1ccc(cc1)C
Properties
Complexity:
206
Compound Is Canonicalized:
No
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.052g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
160.172g/mol
Monoisotopic Mass:
160.052g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.