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Home Other Building Blocks methyl (2E)-4-(4-methoxyphenyl)-4-oxobut-2-enoate, E

methyl (2E)-4-(4-methoxyphenyl)-4-oxobut-2-enoate, E

CAS No.:
32149-29-4
Catalog Number:
AG01E7EV
Molecular Formula:
C12H12O4
Molecular Weight:
220.2213
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Product Description
Catalog Number:
AG01E7EV
Chemical Name:
methyl (2E)-4-(4-methoxyphenyl)-4-oxobut-2-enoate, E
CAS Number:
32149-29-4
Molecular Formula:
C12H12O4
Molecular Weight:
220.2213
MDL Number:
MFCD11099480
IUPAC Name:
methyl (E)-4-(4-methoxyphenyl)-4-oxobut-2-enoate
InChI:
InChI=1S/C12H12O4/c1-15-10-5-3-9(4-6-10)11(13)7-8-12(14)16-2/h3-8H,1-2H3/b8-7+
InChI Key:
PZFZTRCQJQJNNP-BQYQJAHWSA-N
SMILES:
COC(=O)/C=C/C(=O)c1ccc(cc1)OC
Properties
Complexity:
275  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
220.074g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
220.224g/mol
Monoisotopic Mass:
220.074g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties