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66762-68-3 | Ethyl 4-methoxy-3-oxobutanoate
CAS No: 66762-68-3 Catalog No: AG003QB9 MDL No:MFCD07783018
Product Description
Catalog Number:
AG003QB9
Chemical Name:
Ethyl 4-methoxy-3-oxobutanoate
CAS Number:
66762-68-3
Molecular Formula:
C7H12O4
Molecular Weight:
160.1678
MDL Number:
MFCD07783018
IUPAC Name:
ethyl 4-methoxy-3-oxobutanoate
InChI:
InChI=1S/C7H12O4/c1-3-11-7(9)4-6(8)5-10-2/h3-5H2,1-2H3
InChI Key:
CMKOJBYFNYDATH-UHFFFAOYSA-N
SMILES:
CCOC(=O)CC(=O)COC
Properties
Complexity:
141
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.074g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
160.169g/mol
Monoisotopic Mass:
160.074g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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