Home Other Building Blocks ethyl 6-methoxy-3-oxohexanoate

ethyl 6-methoxy-3-oxohexanoate

CAS No.:
1227787-88-3
Catalog Number:
AG01C56D
Molecular Formula:
C9H16O4
Molecular Weight:
188.2209
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Product Description
Catalog Number:
AG01C56D
Chemical Name:
ethyl 6-methoxy-3-oxohexanoate
CAS Number:
1227787-88-3
Molecular Formula:
C9H16O4
Molecular Weight:
188.2209
MDL Number:
MFCD21125644
IUPAC Name:
ethyl 6-methoxy-3-oxohexanoate
InChI:
InChI=1S/C9H16O4/c1-3-13-9(11)7-8(10)5-4-6-12-2/h3-7H2,1-2H3
InChI Key:
VUCFQBNPRHCETH-UHFFFAOYSA-N
SMILES:
COCCCC(=O)CC(=O)OCC
Properties
Complexity:
165  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.105g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.223g/mol
Monoisotopic Mass:
188.105g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties