Home Other Building Blocks 3-ethoxy-4-methylpentanoic acid

3-ethoxy-4-methylpentanoic acid

CAS No.:
1394040-27-7
Catalog Number:
AG019ZTU
Molecular Formula:
C8H16O3
Molecular Weight:
160.2108
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Product Description
Catalog Number:
AG019ZTU
Chemical Name:
3-ethoxy-4-methylpentanoic acid
CAS Number:
1394040-27-7
Molecular Formula:
C8H16O3
Molecular Weight:
160.2108
MDL Number:
MFCD22375339
IUPAC Name:
3-ethoxy-4-methylpentanoic acid
InChI:
InChI=1S/C8H16O3/c1-4-11-7(6(2)3)5-8(9)10/h6-7H,4-5H2,1-3H3,(H,9,10)
InChI Key:
QTMMKLKTPSAIPQ-UHFFFAOYSA-N
SMILES:
CCOC(C(C)C)CC(=O)O
Properties
Complexity:
121  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.11g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
160.213g/mol
Monoisotopic Mass:
160.11g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties