Home Other Building Blocks 2-methoxy-4-methylpentanoic acid

2-methoxy-4-methylpentanoic acid

CAS No.:
78814-97-8
Catalog Number:
AG01C32H
Molecular Formula:
C7H14O3
Molecular Weight:
146.1843
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Product Description
Catalog Number:
AG01C32H
Chemical Name:
2-methoxy-4-methylpentanoic acid
CAS Number:
78814-97-8
Molecular Formula:
C7H14O3
Molecular Weight:
146.1843
MDL Number:
MFCD19229805
IUPAC Name:
2-methoxy-4-methylpentanoic acid
InChI:
InChI=1S/C7H14O3/c1-5(2)4-6(10-3)7(8)9/h5-6H,4H2,1-3H3,(H,8,9)
InChI Key:
MJHYCHHBCQHJNB-UHFFFAOYSA-N
SMILES:
COC(C(=O)O)CC(C)C
Properties
Complexity:
109  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.094g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
146.186g/mol
Monoisotopic Mass:
146.094g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties