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C10H14ClN3O4CAS 51391-96-9275.69 g/mol

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NOOHOHONHNHCl
AlcoholEther

Properties

Molecular formula
C10H14ClN3O4
Molar mass
275.69 g/mol
Exact mass
275.0673 Da
logP
-0.90Crippen estimate
Polar surface area
100.6 Ų
H-bond donors / acceptors
3 / 6
Rotatable bonds
1
Stereocentres
R, S, R, Rin SMILES atom order

Hazards

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

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Identifiers

CAS number
51391-96-9
SMILES
CC1=CN2[C@H]3[C@H]([C@@H]([C@H](O3)CO)O)OC2=NC1=N.Cl
InChIKey
NTLAKIOXMNOMIC-HSMTUSTJSA-N
InChI
InChI=1S/C10H13N3O4.ClH/c1-4-2-13-9-7(6(15)5(3-14)16-9)17-10(13)12-8(4)11;/h2,5-7,9,11,14-15H,3H2,1H3;1H/t5-,6-,7+,9-;/m1./s1

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Names and synonyms

1 names
  • 5-Methylcyclocytidine hydrochlorine

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Tanimoto similarity of circular fingerprints over the whole catalogue.

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Elsewhere

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