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25103-52-0 |
CAS No: 25103-52-0 Catalog No: AG01FP0S MDL No:
Product Description
Catalog Number:
AG01FP0S
CAS Number:
25103-52-0
IUPAC Name:
6-methylheptanoic acid
InChI:
InChI=1S/C8H16O2/c1-7(2)5-3-4-6-8(9)10/h7H,3-6H2,1-2H3,(H,9,10)
InChI Key:
OEOIWYCWCDBOPA-UHFFFAOYSA-N
EC Number:
246-617-0
UNII:
7R20G8CX85
Properties
Complexity:
97.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.115g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
144.214g/mol
Monoisotopic Mass:
144.115g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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