200,000+ products from a single source!
sales@angenechem.com
15725-15-2 | 2,4-Pentanedione, 3-[(3-chlorophenyl)methylene]-
CAS No: 15725-15-2 Catalog No: AG001PBV MDL No:
Product Description
Catalog Number:
AG001PBV
Chemical Name:
2,4-Pentanedione, 3-[(3-chlorophenyl)methylene]-
CAS Number:
15725-15-2
Molecular Formula:
C12H11ClO2
Molecular Weight:
222.6675
IUPAC Name:
3-[(3-chlorophenyl)methylidene]pentane-2,4-dione
InChI:
InChI=1S/C12H11ClO2/c1-8(14)12(9(2)15)7-10-4-3-5-11(13)6-10/h3-7H,1-2H3
InChI Key:
MXUHWQIVJPLIGF-UHFFFAOYSA-N
SMILES:
Clc1cccc(c1)C=C(C(=O)C)C(=O)C
NSC Number:
637176
Properties
Complexity:
278
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.045g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.668g/mol
Monoisotopic Mass:
222.045g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Related Products
© 2019 Angene International Limited. All rights Reserved.