chempirical

Isosorbide mononitrate

C6H9NO6CAS 16051-77-7191.14 g/mol

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AlcoholEtherNitro

Properties

Molecular formula
C6H9NO6
Molar mass
191.14 g/mol
Exact mass
191.0430 Da
Melting point
88–91 °C
logP
-1.28Crippen estimate
Polar surface area
91.1 Ų
H-bond donors / acceptors
1 / 6
Rotatable bonds
2
Stereocentres
R, R, S, Sin SMILES atom order

Identifiers

CAS number
16051-77-7
SMILES
O=[N+]([O-])O[C@@H]1CO[C@H]2[C@@H]1OC[C@@H]2O
InChIKey
YWXYYJSYQOXTPL-SLPGGIOYSA-N
InChI
InChI=1S/C6H9NO6/c8-3-1-11-6-4(13-7(9)10)2-12-5(3)6/h3-6,8H,1-2H2/t3-,4+,5+,6+/m0/s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

76 names · show all
  • D-Glucitol, 1,4:3,6-dianhydro-, 5-nitrate
  • Glucitol, 1,4:3,6-dianhydro-, 5-nitrate, D-
  • Furo[3,2-b]furan, D-glucitol deriv.
  • Isosorbide 5-mononitrate
  • 1,4:3,6-Dianhydro-D-glucitol 5-nitrate
  • Isosorbide 5-nitrate
  • IS 5MN
  • AHR 4698
  • BM 22-145
  • Monizid
  • Imdur
  • Multitab
  • Ismo
  • Monoket
  • Monolong
  • Mono-mack
  • Imodur
  • Monoket OD
  • Mononit retard 50
  • Mononit 40
  • Ismox
  • Monolong 60
  • Medocor
  • Nitramin
  • Corangin SR
  • Conpin
  • Monotrate
  • Ismo 20
  • Isomonat
  • Monopront
  • Monicor
  • Corangin
  • Isomonit
  • Mono-sanorania
  • Elantan
  • Imdur 60
  • Ismexin
  • ISMN
  • Isopen 20
  • Monodur durules
  • Monocord 20
  • Imdur durules
  • Isomon
  • Mononit 20
  • Imtrate
  • Mono corax
  • Monoket retard
  • Mono corax retard
  • Monosorbitrate
  • Monit 20
  • Pentacard
  • Elantan long
  • Pentacard 20
  • Monis
  • Iturol
  • Conpin retardkaps
  • Vasotrate
  • Monovas
  • Monoclair
  • Mononit
  • Duride
  • Monocord 40
  • Monolong 40
  • Monosordil
  • Elan
  • Monocord 50SR
  • Elantan retard
  • Dilavenil
  • Mono-cedocard
  • Monosorb
  • Momo mack
  • Olicard
  • Monit
  • Geomatrix
  • Ormox
  • Monizol

Work with Isosorbide mononitrate

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

Isosorbide dinitrate87-33-276 % similar Isomannide641-74-748 % similar Isosorbide652-67-548 % similar Nitroglycerin55-63-039 % similar Isopropyl nitrate1712-64-734 % similar P-Nitrophenyl β-D-xylopyranoside2001-96-931 % similar 1,3:4,6-Di-O-benzylidene-D-mannitol28224-73-930 % similar Isoamyl nitrate543-87-330 % similar

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

Same formula

Nitrilotriacetic acid139-13-9

Elsewhere

PubChem CAS Common Chemistry NIST WebBook