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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 20280852Generated: October 31, 2026

1-Amino-2-(3-hydroxypropylamino)cyclobut-1-ene-3,4-dione

https://huagongshe.com/en/chemical/20280852

1-Amino-2-(3-hydroxypropylamino)cyclobut-1-ene-3,4-dione molecular structure

Identifiers & Physical Properties

CAS No.91100-07-1
Molecular formulaC7H10N2O3
Average molar mass170.17 g/mol
Monoisotopic mass170.06914218 g/mol
SMILESNc1c(NCCCO)c(=O)c1=O
InChIKeySRNGAYDJIBZIHZ-UHFFFAOYSA-N
PubChem CID20280852
DTXSIDDTXSID90604596

Chemical & Physical Properties

XLogP-0.5
Topological polar surface area92.4
Hydrogen bond donors3
Hydrogen bond acceptors5
Rotatable bonds4
Heavy atoms12
Formal charge0
Complexity257