200,000+ products from a single source!
sales@angenechem.com
Home > Fluorides > 144224-15-7
144224-15-7 | 4-Pentenoic acid, 5-(4-fluorophenyl)-3-oxo-, methyl ester
CAS No: 144224-15-7 Catalog No: AG001J4H MDL No:MFCD12756191
Product Description
Catalog Number:
AG001J4H
Chemical Name:
4-Pentenoic acid, 5-(4-fluorophenyl)-3-oxo-, methyl ester
CAS Number:
144224-15-7
Molecular Formula:
C12H11FO3
Molecular Weight:
222.2123
MDL Number:
MFCD12756191
IUPAC Name:
methyl (E)-5-(4-fluorophenyl)-3-oxopent-4-enoate
InChI:
InChI=1S/C12H11FO3/c1-16-12(15)8-11(14)7-4-9-2-5-10(13)6-3-9/h2-7H,8H2,1H3/b7-4+
InChI Key:
CCOOSUHKOAJBDD-QPJJXVBHSA-N
SMILES:
COC(=O)CC(=O)C=Cc1ccc(cc1)F
Properties
Complexity:
278
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
222.069g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.215g/mol
Monoisotopic Mass:
222.069g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.