200,000+ products from a single source!
sales@angenechem.com
287481-47-4 | 2,4-Pentadienoic acid, 2-bromo-5-phenyl-, methyl ester, (2E,4E)-
CAS No: 287481-47-4 Catalog No: AG002WBP MDL No:
Product Description
Catalog Number:
AG002WBP
Chemical Name:
2,4-Pentadienoic acid, 2-bromo-5-phenyl-, methyl ester, (2E,4E)-
CAS Number:
287481-47-4
Molecular Formula:
C12H11BrO2
Molecular Weight:
267.1185
IUPAC Name:
methyl 2-bromo-5-phenylpenta-2,4-dienoate
InChI:
InChI=1S/C12H11BrO2/c1-15-12(14)11(13)9-5-8-10-6-3-2-4-7-10/h2-9H,1H3
InChI Key:
DDKPTRNVTMXUHM-UHFFFAOYSA-N
SMILES:
COC(=O)/C(=C\C=C\c1ccccc1)/Br
Properties
Complexity:
263
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.994g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
267.122g/mol
Monoisotopic Mass:
265.994g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
3.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.