Ancitabine hydrochloride

C9H12ClN3O4CAS 10212-25-6261.66 g/mol

HClNHNNOOHHOO
AlcoholEther

Properties

Molecular formula
C9H12ClN3O4
Molar mass
261.66 g/mol
Exact mass
261.0516 Da
Melting point
248–250 °C
logP
-1.20Crippen estimate
Polar surface area
100.6 Ų
H-bond donors / acceptors
3 / 6
Rotatable bonds
1
Stereocentres
S, R, R, Rin SMILES atom order

Hazards

Warning
Irritant (GHS07)

Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
10212-25-6
SMILES
Cl.N=c1ccn2c(n1)O[C@H]1[C@H](O)[C@@H](CO)O[C@H]12
InChIKey
KZOWNALBTMILAP-JBMRGDGGSA-N
InChI
InChI=1S/C9H11N3O4.ClH/c10-5-1-2-12-8-7(16-9(12)11-5)6(14)4(3-13)15-8;/h1-2,4,6-8,10,13-14H,3H2;1H/t4-,6-,7+,8-;/m1./s1

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Names and synonyms

18 names · show all
  • 6H-Furo[2′,3′:4,5]oxazolo[3,2-a]pyrimidine-2-methanol, 2,3,3a,9a-tetrahydro-3-hydroxy-6-imino-, hydrochloride (1:1), (2R,3R,3aS,9aR)-
  • 6H-Furo[2′,3′:4,5]oxazolo[3,2-a]pyrimidine-2-methanol, 2,3,3a,9a-tetrahydro-3-hydroxy-6-imino-, monohydrochloride, stereoisomer
  • 6H-Furo[2′,3′:4,5]oxazolo[3,2-a]pyrimidine-2-methanol, 2,3,3a,9a-tetrahydro-3-hydroxy-6-imino-, monohydrochloride, [2R-(2α,3β,3aβ,9aβ)]-
  • 6H-Furo[2′,3′:4,5]oxazolo[3,2-a]pyrimidine-2-methanol, 2,3,3a,9a-tetrahydro-3-hydroxy-6-imino-, hydrochloride
  • 6H-Furo[2′,3′:4,5]oxazolo[3,2-a]pyrimidine-2-methanol, 2,3,3a,9a-tetrahydro-3-hydroxy-6-imino-, monohydrochloride, (2R,3R,3aS,9aR)-
  • 2,2′-O-Cyclocytidine hydrochloride
  • O2,O2′-Anhydro-1-β-arabinofuranosylcytosine hydrochloride
  • O2,O2′-Anhydro-1-β-D-arabinofuranosylcytosine monohydrochloride
  • Cyclo-CMP hydrochloride
  • Cyclocytidine hydrochloride
  • 2,2′-Anhydroarabinosylcytosine hydrochloride
  • 2,2′-Anhydrocytidine hydrochloride
  • 2,2′-Cyclocytidine hydrochloride
  • 2,2′-Anhydro-1-β-D-arabinofuranosylcytosine monohydrochloride
  • NSC 145668
  • 2,2′-Anhydroaracytidine hydrochloride
  • 2,2′-Anhydro-1-β-D-arabinofuranosylcytosine hydrochloride
  • OCTD hydrochloride

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Similar compounds

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

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