200,000+ products from a single source!
sales@angenechem.com
Home > Carboxes > 1260842-79-2
1260842-79-2 | Ethyl (3-iso-propylbenzoyl)acetate
CAS No: 1260842-79-2 Catalog No: AG01FE47 MDL No:
Product Description
Catalog Number:
AG01FE47
Chemical Name:
Ethyl (3-iso-propylbenzoyl)acetate
CAS Number:
1260842-79-2
Molecular Formula:
C14H18O3
Molecular Weight:
234.2909
IUPAC Name:
ethyl 3-oxo-3-(3-propan-2-ylphenyl)propanoate
InChI:
InChI=1S/C14H18O3/c1-4-17-14(16)9-13(15)12-7-5-6-11(8-12)10(2)3/h5-8,10H,4,9H2,1-3H3
InChI Key:
FWSUFQHISQQOJK-UHFFFAOYSA-N
SMILES:
CCOC(=O)CC(=O)c1cccc(c1)C(C)C
Properties
Complexity:
271
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.126g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
234.295g/mol
Monoisotopic Mass:
234.126g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
Related Products
© 2019 Angene International Limited. All rights Reserved.