chempirical

Norprostol

C13H20O4CAS 40098-26-8240.30 g/mol

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Properties

Molecular formula
C13H20O4
Molar mass
240.30 g/mol
Exact mass
240.1362 Da
logP
1.76Crippen estimate
Polar surface area
63.6 Ų
H-bond donors / acceptors
1 / 4
Rotatable bonds
7

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
40098-26-8
SMILES
COC(=O)CCCCCCC1=CC(CC1=O)O
InChIKey
PQKUWAVOSCVDCT-UHFFFAOYSA-N
InChI
InChI=1S/C13H20O4/c1-17-13(16)7-5-3-2-4-6-10-8-11(14)9-12(10)15/h8,11,14H,2-7,9H2,1H3

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Names and synonyms

1 names
  • Methyl 7-[(3rs)-3-hydroxy-5-oxocyclopent-1-enyl]heptanoate

Work with Norprostol

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Dimethyl sebacate106-79-651 % similar Dimethyl octadecanedioate1472-93-151 % similar 1,12-Dimethyl dodecanedioate1731-79-951 % similar Dimethyl pimelate1732-08-751 % similar Dimethyl suberate1732-09-851 % similar Dimethyl azelate1732-10-151 % similar Dimethyl adipate627-93-049 % similar 6-Hydroxyhexanoic acid methyl ester4547-43-748 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Neopentyl glycol dimethacrylate1985-51-9 Diethyl diallylmalonate3195-24-2 Triethylene glycol monobenzyl ether55489-58-2

Elsewhere

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