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1781334-12-0 | Cyclopentanecarboxylic acid, 3-fluoro-4-hydroxy-, methyl ester
CAS No: 1781334-12-0 Catalog No: AG0025SA MDL No:
Product Description
Catalog Number:
AG0025SA
Chemical Name:
Cyclopentanecarboxylic acid, 3-fluoro-4-hydroxy-, methyl ester
CAS Number:
1781334-12-0
Molecular Formula:
C7H11FO3
Molecular Weight:
162.1588
IUPAC Name:
methyl 3-fluoro-4-hydroxycyclopentane-1-carboxylate
InChI:
InChI=1S/C7H11FO3/c1-11-7(10)4-2-5(8)6(9)3-4/h4-6,9H,2-3H2,1H3
InChI Key:
RCABWLOYEULSPO-UHFFFAOYSA-N
SMILES:
COC(=O)C1CC(C(C1)O)F
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.069g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
162.16g/mol
Monoisotopic Mass:
162.069g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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