4-[(2,4-diaminopyrimidin-5-yl)methylideneamino]benzoic acid

Modify Date: 2025-09-21 21:32:17

4-[(2,4-diaminopyrimidin-5-yl)methylideneamino]benzoic acid Structure
4-[(2,4-diaminopyrimidin-5-yl)methylideneamino]benzoic acid structure
Common Name 4-[(2,4-diaminopyrimidin-5-yl)methylideneamino]benzoic acid
CAS Number 20781-10-6 Molecular Weight 293.70900
Density 1.5g/cm3 Boiling Point 632.7ºC at 760 mmHg
Molecular Formula C12H12ClN5O2 Melting Point N/A
MSDS N/A Flash Point 336.4ºC

 Names

Name 4-[(2,4-diaminopyrimidin-5-yl)methylideneamino]benzoic acid,hydrochloride

 Chemical & Physical Properties

Density 1.5g/cm3
Boiling Point 632.7ºC at 760 mmHg
Molecular Formula C12H12ClN5O2
Molecular Weight 293.70900
Flash Point 336.4ºC
Exact Mass 293.06800
PSA 127.48000
LogP 3.05420
Vapour Pressure 7.05E-17mmHg at 25°C
Index of Refraction 1.718
InChIKey AXWMCMRZVBAQCG-UHFFFAOYSA-N
SMILES Cl.Nc1ncc(C=Nc2ccc(C(=O)O)cc2)c(N)n1
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