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Structure

4-Methylvaleric acid

CAS
646-07-1
Catalog Number
ACM646071
Category
Other Products
Molecular Weight
116.16
Molecular Formula
C6H12O2
MSDS COA Spec Sheet

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Specification

Synonyms
Isocaproic acid
Complexity
77
Defined Atom Stereocenter Count
0
Exact Mass
116.0837
Formal Charge
0
Heavy Atom Count
8
Hydrogen Bond Acceptor Count
2
Hydrogen Bond Donor Count
1
Isotope Atom Count
0
Monoisotopic Mass
116.0837
Rotatable Bond Count
3
Topological Polar Surface Area
37.3 Ų
XLogP3-AA
1.4
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