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76968-33-7 | (+/-)-Dihydrojasmonic Acid , 98%
CAS No: 76968-33-7 Catalog No: AG003BDT MDL No:
Product Description
Catalog Number:
AG003BDT
Chemical Name:
(+/-)-Dihydrojasmonic Acid , 98%
CAS Number:
76968-33-7
IUPAC Name:
2-(3-oxo-2-pentylcyclopentyl)acetic acid
InChI:
InChI=1S/C12H20O3/c1-2-3-4-5-10-9(8-12(14)15)6-7-11(10)13/h9-10H,2-8H2,1H3,(H,14,15)
InChI Key:
PQEYTAGBXNEUQL-UHFFFAOYSA-N
EC Number:
222-687-8
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.141g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
212.289g/mol
Monoisotopic Mass:
212.141g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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