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59995-48-1 | (4R)-4-(Acetyloxy)-2-cyclopenten-1-one
CAS No: 59995-48-1 Catalog No: AG0038M5 MDL No:MFCD01318189
Product Description
Catalog Number:
AG0038M5
Chemical Name:
(4R)-4-(Acetyloxy)-2-cyclopenten-1-one
CAS Number:
59995-48-1
Molecular Formula:
C7H8O3
Molecular Weight:
140.1366
MDL Number:
MFCD01318189
IUPAC Name:
[(1R)-4-oxocyclopent-2-en-1-yl] acetate
InChI:
InChI=1S/C7H8O3/c1-5(8)10-7-3-2-6(9)4-7/h2-3,7H,4H2,1H3/t7-/m0/s1
InChI Key:
YNCKAQVPQJWLJW-ZETCQYMHSA-N
SMILES:
CC(=O)O[C@H]1C=CC(=O)C1
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
140.047g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
140.138g/mol
Monoisotopic Mass:
140.047g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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