Home Other Building Blocks methyl 3-methyl-5-phenylpent-2-enoate

methyl 3-methyl-5-phenylpent-2-enoate

CAS No.:
61439-80-3
Catalog Number:
AG01AFZE
Molecular Formula:
C13H16O2
Molecular Weight:
204.2649
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Product Description
Catalog Number:
AG01AFZE
Chemical Name:
methyl 3-methyl-5-phenylpent-2-enoate
CAS Number:
61439-80-3
Molecular Formula:
C13H16O2
Molecular Weight:
204.2649
MDL Number:
MFCD27920287
IUPAC Name:
methyl 3-methyl-5-phenylpent-2-enoate
InChI:
InChI=1S/C13H16O2/c1-11(10-13(14)15-2)8-9-12-6-4-3-5-7-12/h3-7,10H,8-9H2,1-2H3
InChI Key:
COLHOBDBQPCZGQ-UHFFFAOYSA-N
SMILES:
COC(=O)C=C(CCc1ccccc1)C
Properties
Complexity:
225  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.115g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.269g/mol
Monoisotopic Mass:
204.115g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
3.4  
Properties