Home Other Building Blocks Pentanedioic acid, 2-methylene-, 5-methyl ester

Pentanedioic acid, 2-methylene-, 5-methyl ester

CAS No.:
93633-32-0
Catalog Number:
AG006ETB
Molecular Formula:
C7H9O4-
Molecular Weight:
157.1440
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Product Description
Catalog Number:
AG006ETB
Chemical Name:
Pentanedioic acid, 2-methylene-, 5-methyl ester
CAS Number:
93633-32-0
Molecular Formula:
C7H9O4-
Molecular Weight:
157.1440
MDL Number:
MFCD20638960
IUPAC Name:
5-methoxy-2-methylidene-5-oxopentanoate
InChI:
InChI=1S/C7H10O4/c1-5(7(9)10)3-4-6(8)11-2/h1,3-4H2,2H3,(H,9,10)/p-1
InChI Key:
OKHGTVXZDNDAGT-UHFFFAOYSA-M
SMILES:
COC(=O)CCC(=C)C(=O)[O-]
Properties
Complexity:
177  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.05g/mol
Formal Charge:
-1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
157.145g/mol
Monoisotopic Mass:
157.05g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties