200,000+ products from a single source!
sales@angenechem.com
Home > Carboxes > 1247776-11-9
1247776-11-9 | Methyl 4-(3,5-dichlorophenyl)-4-oxobutyrate
CAS No: 1247776-11-9 Catalog No: AG01FAVN MDL No:
Product Description
Catalog Number:
AG01FAVN
Chemical Name:
Methyl 4-(3,5-dichlorophenyl)-4-oxobutyrate
CAS Number:
1247776-11-9
Molecular Formula:
C11H10Cl2O3
Molecular Weight:
261.1013
IUPAC Name:
methyl 4-(3,5-dichlorophenyl)-4-oxobutanoate
InChI:
InChI=1S/C11H10Cl2O3/c1-16-11(15)3-2-10(14)7-4-8(12)6-9(13)5-7/h4-6H,2-3H2,1H3
InChI Key:
YGCXCDBBQXJQSH-UHFFFAOYSA-N
SMILES:
COC(=O)CCC(=O)c1cc(Cl)cc(c1)Cl
Properties
Complexity:
258
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.001g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
261.098g/mol
Monoisotopic Mass:
260.001g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
Related Products
© 2019 Angene International Limited. All rights Reserved.