200,000+ products from a single source!
sales@angenechem.com
Home > Aldehydes > 137655-57-3
137655-57-3 | Benzaldehyde, 3-(3-chloro-5-oxo-1,3-pentadien-1-yl)-
CAS No: 137655-57-3 Catalog No: AG0013PI MDL No:
Product Description
Catalog Number:
AG0013PI
Chemical Name:
Benzaldehyde, 3-(3-chloro-5-oxo-1,3-pentadien-1-yl)-
CAS Number:
137655-57-3
Molecular Formula:
C12H9ClO2
Molecular Weight:
220.6517
IUPAC Name:
3-(3-chloro-5-oxopenta-1,3-dienyl)benzaldehyde
InChI:
InChI=1S/C12H9ClO2/c13-12(6-7-14)5-4-10-2-1-3-11(8-10)9-15/h1-9H
InChI Key:
YIXKELHNMNYCIW-UHFFFAOYSA-N
SMILES:
O=CC=C(C=Cc1cccc(c1)C=O)Cl
Properties
Complexity:
281
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.029g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
220.652g/mol
Monoisotopic Mass:
220.029g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
2.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.