200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 127921-80-6
127921-80-6 | 2-Butenal, 4-oxo-4-phenyl-, (2E)-
CAS No: 127921-80-6 Catalog No: AG000XKF MDL No:
Product Description
Catalog Number:
AG000XKF
Chemical Name:
2-Butenal, 4-oxo-4-phenyl-, (2E)-
CAS Number:
127921-80-6
Molecular Formula:
C10H8O2
Molecular Weight:
160.1693
IUPAC Name:
4-oxo-4-phenylbut-2-enal
InChI:
InChI=1S/C10H8O2/c11-8-4-7-10(12)9-5-2-1-3-6-9/h1-8H
InChI Key:
YJXXWALABNEMPS-UHFFFAOYSA-N
SMILES:
O=C/C=C/C(=O)c1ccccc1
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.052g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
160.172g/mol
Monoisotopic Mass:
160.052g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.