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3-nitro-2-pentanol

PropertiesImage
MNX_IDMNXM36670 Image of MNXM36670
referencechebi:138493
formulaC5H11NO3
global charge0
mol weight133.147
InChIKeyCHOTTWGZEKCPHA-UHFFFAOYSA-N
InChIInChI=1S/C5H11NO3/c1-3-5(4(2)7)6(8)9/h4-5,7H,3H2,1-2H3
SMILESCCC(C(C)O)[N+](=O)[O-]
MNX internals
InChI (mnx)InChI=1/C5H11NO3/c1-3-5(4(2)7)6(8)9/h4-5,7H,3H2,1-2H3/t4?,5? Image of MNXM36670
SMILES (mnx)[CH3:1][CH2:3][CH:5]([CH:4]([CH3:2])[OH:7])[N+:6]([O-:8])=[O:9]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

metacyc.compound:CPD-8128
metacycM:CPD-8128
seed.compound:cpd25052
seedM:cpd25052
CHEBI:138493
chebi:138493
CHOTTWGZEKCPHA-UHFFFAOYSA-N
3-nitro-2-pentanol

sabiork.compound:30718
sabiorkM:30718
CHOTTWGZEKCPHA-UHFFFAOYSA-N
3-Nitro-2-pentanol
3-Nitropentan-2-ol

seedM:M_cpd25052
secondary/obsolete/fantasy identifier