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4-(2-Hydrazino-2-oxoethoxy)benzoic acid

HCID 9855838
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
NNC(=O)COc1ccc(C(=O)O)cc1
InChIKey
JTPHAWTXXACFMM-UHFFFAOYSA-N
Molecular formula
C9H10N2O4
Average molar mass
210.19 g/mol
Monoisotopic mass
210.0640568

Names & identifiers

Preferred name
4-(2-Hydrazino-2-oxoethoxy)benzoic acid
IUPAC
4-(2-hydrazinyl-2-oxoethoxy)benzoic acid

Names & synonyms

SCHEMBL2835976JTPHAWTXXACFMM-UHFFFAOYSA-N4-(2-hydrazino-2-oxoethoxy)benzoic acid521289-48-5DB-105862

Database identifiers

PubChem CID
9855838

Properties

Computed structural properties

XLogP
-2.3
Topological polar surface area
102 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
15
Formal charge
0
Complexity
236

Related reactions

4 records
New reaction record
HRID 124720 reaction equation
HRID 124720As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 642081 reaction equation
HRID 642081As productuspto-grants-2010_04
HRID 642082 reaction equation
HRID 642082As reactantuspto-grants-2010_04
HRID 1138196 reaction equation
HRID 1138196As productTraining data from https://doi.org/10.1039/C8SC04228D (7/10)

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes