2-((2-Nitro-1H-imidazol-1-yl)methoxy)-1,3-propanediol

HCID 129146CAS 120398-89-2

Basic information

Standard SMILES
O=[N+]([O-])c1nccn1COC(CO)CO
InChIKey
DWSFCAKOSWFTCK-UHFFFAOYSA-N
Molecular formula
C7H11N3O5
Average molar mass
217.18 g/mol
Monoisotopic mass
217.06987046

Names & identifiers

Preferred name
2-((2-Nitro-1H-imidazol-1-yl)methoxy)-1,3-propanediol
IUPAC
2-[(2-nitroimidazol-1-yl)methoxy]propane-1,3-diol
English name
RP 170
Molecular formula
C7H11N3O5
Molecular weight
217.18

Names & synonyms

RP 170120398-89-22-((2-Nitro-1H-imidazol-1-yl)methoxy)-1,3-propanediolDTXSID901528402-[(2-Nitro-1H-imidazol-1-yl)methoxy]-1,3-propanediol1,3-Propanediol, 2-((2-nitro-1H-imidazol-1-yl)methoxy)-RefChem:179996DTXCID3075331RP-1702-[(2-nitroimidazol-1-yl)methoxy]propane-1,3-diol1-(2-hydroxy-1-(hydroxymethyl)ethoxy)methyl-2-nitroimidazole1-[2-hydroxy-1-(hydroxymethyl)ethoxy]methyl-2-nitroimidazole
Show more names
1,3-Propanediol, 2-[(2-nitro-1H-imidazol-1-yl)methoxy]-
SCHEMBL50505842-[(2-nitro-1H-imidazol-1-yl)methoxy]propane-1,3-diolDWSFCAKOSWFTCK-UHFFFAOYSA-N1-[2-hydroxy-1-(hydroxymethyl)ethoxy]methyl-2nitroimidazol1-[2-hydroxy-1-(hydroxymethyl)ethoxy]methyl-2-nitroimidazol

Database identifiers

CAS
120398-89-2
PubChem CID
129146
DTXSID
DTXSID90152840
Nikkaji
J397.922I

Properties

Computed structural properties

XLogP
-1.2
Topological polar surface area
113 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
15

Chemistry & industry

Suppliers1 total

杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]

Related reactions

3 records

Linked notes

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