Home Other Building Blocks 1-methoxy-4-methylpentan-3-one

1-methoxy-4-methylpentan-3-one

CAS No.:
1250407-40-9
Catalog Number:
AG01AIU9
Molecular Formula:
C7H14O2
Molecular Weight:
130.1849
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Product Description
Catalog Number:
AG01AIU9
Chemical Name:
1-methoxy-4-methylpentan-3-one
CAS Number:
1250407-40-9
Molecular Formula:
C7H14O2
Molecular Weight:
130.1849
MDL Number:
MFCD14661410
IUPAC Name:
1-methoxy-4-methylpentan-3-one
InChI:
InChI=1S/C7H14O2/c1-6(2)7(8)4-5-9-3/h6H,4-5H2,1-3H3
InChI Key:
VUEKVRBSKXKONO-UHFFFAOYSA-N
SMILES:
COCCC(=O)C(C)C
Properties
Complexity:
86.9  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
130.099g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
130.187g/mol
Monoisotopic Mass:
130.099g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties