7-Amino-2,3-dihydro-1,4-benzodioxine-5-carboxylic acid

HCID 20544752
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Basic information

Standard SMILES
Nc1cc2c(c(C(=O)O)c1)OCCO2
InChIKey
FSRYNXDRMYDGKD-UHFFFAOYSA-N
Molecular formula
C9H9NO4
Average molar mass
195.17 g/mol

Names & identifiers

Preferred name
7-Amino-2,3-dihydro-1,4-benzodioxine-5-carboxylic acid
IUPAC
7-amino-2,3-dihydro-1,4-benzodioxine-5-carboxylic acid

Names & synonyms

7-amino-2,3-dihydro-1,4-benzodioxine-5-carboxylic acid66410-92-2SCHEMBL9053612FSRYNXDRMYDGKD-UHFFFAOYSA-NRCA41092AKOS0123231187-amino-1,4-benzodioxane-5-carboxylic acidEN300-1005787-amino-2,3-dihydro-1,4-benzodioxine-5-carboxylicacidZ1079174684

Database identifiers

PubChem CID
20544752

Properties

Computed structural properties

XLogP
0.5
Topological polar surface area
81.8 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
1
Heavy atoms
14

Related reactions

16 records
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Compound notes

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