9-(2-Carboxylato-4-carboxyphenyl)-3,6-bis(diethylamino)xanthylium

Modify Date: 2025-09-13 16:15:31

9-(2-Carboxylato-4-carboxyphenyl)-3,6-bis(diethylamino)xanthylium Structure
9-(2-Carboxylato-4-carboxyphenyl)-3,6-bis(diethylamino)xanthylium structure
Common Name 9-(2-Carboxylato-4-carboxyphenyl)-3,6-bis(diethylamino)xanthylium
CAS Number 90066-13-0 Molecular Weight 486.55900
Density N/A Boiling Point N/A
Molecular Formula C29H30N2O5 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 3-carboxy-4-[3-(diethylamino)-6-diethylazaniumylidenexanthen-9-yl]benzoate

 Chemical & Physical Properties

Molecular Formula C29H30N2O5
Molecular Weight 486.55900
Exact Mass 486.21500
PSA 97.05000
LogP 5.28820
InChIKey NZRQKXUQAXJACC-UHFFFAOYSA-N
SMILES CCN(CC)c1ccc2c(-c3ccc(C(=O)[O-])cc3C(=O)O)c3ccc(=[N+](CC)CC)cc-3oc2c1
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