Home Other Building Blocks methyl 3-methyl-4-oxopent-2-enoate

methyl 3-methyl-4-oxopent-2-enoate

CAS No.:
53663-12-0
Catalog Number:
AG01A1AU
Molecular Formula:
C7H10O3
Molecular Weight:
142.1525
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Product Description
Catalog Number:
AG01A1AU
Chemical Name:
methyl 3-methyl-4-oxopent-2-enoate
CAS Number:
53663-12-0
Molecular Formula:
C7H10O3
Molecular Weight:
142.1525
MDL Number:
MFCD22392232
IUPAC Name:
methyl 3-methyl-4-oxopent-2-enoate
InChI:
InChI=1S/C7H10O3/c1-5(6(2)8)4-7(9)10-3/h4H,1-3H3
InChI Key:
JDAODWYVSFNKRR-UHFFFAOYSA-N
SMILES:
COC(=O)C=C(C(=O)C)C
Properties
Complexity:
179  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.063g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
142.154g/mol
Monoisotopic Mass:
142.063g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
0.4  
Properties