(2R,3R)-6-hydroxyhexane-2,3-diyl dinitrate

HCID 59549893
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Basic information

Standard SMILES
C[C@@H](O[N+](=O)[O-])[C@@H](CCCO)O[N+](=O)[O-]
InChIKey
NLYJTKHFBPLQOT-PHDIDXHHSA-N
Molecular formula
C6H12N2O7
Average molar mass
224.17 g/mol

Names & identifiers

Preferred name
(2R,3R)-6-hydroxyhexane-2,3-diyl dinitrate
IUPAC
[(2R,3R)-6-hydroxy-2-nitrooxyhexan-3-yl] nitrate

Names & synonyms

SCHEMBL3064346NLYJTKHFBPLQOT-PHDIDXHHSA-N(2R,3R)-6-hydroxyhexane-2,3-diyl dinitrate

Database identifiers

PubChem CID
59549893

Properties

Computed structural properties

XLogP
1.3
Topological polar surface area
130 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
6
Heavy atoms
15

Related reactions

2 records
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Compound notes

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