4-[5-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,3,4-thiadiazolidin-2-ylidene]cyclohexa-2,5-dien-1-one

Modify Date: 2025-09-20 00:44:49

4-[5-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,3,4-thiadiazolidin-2-ylidene]cyclohexa-2,5-dien-1-one Structure
4-[5-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,3,4-thiadiazolidin-2-ylidene]cyclohexa-2,5-dien-1-one structure
Common Name 4-[5-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,3,4-thiadiazolidin-2-ylidene]cyclohexa-2,5-dien-1-one
CAS Number 88203-23-0 Molecular Weight 270.30600
Density N/A Boiling Point N/A
Molecular Formula C14H10N2O2S Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 4-[5-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,3,4-thiadiazolidin-2-ylidene]cyclohexa-2,5-dien-1-one

 Chemical & Physical Properties

Molecular Formula C14H10N2O2S
Molecular Weight 270.30600
Exact Mass 270.04600
PSA 93.96000
LogP 0.65810
InChIKey XMQUTIMDPCVAAQ-UHFFFAOYSA-N
SMILES Oc1ccc(-c2nnc(-c3ccc(O)cc3)s2)cc1

 Synthetic Route

~95%

4-[5-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,3,4-thiadiazolidin-2-ylidene]cyclohexa-2,5-dien-1-one Structure

4-[5-(4-oxocycl...

CAS#:88203-23-0

Literature: Lebrini, Mounim; Bentiss, Fouad; Lagrenee, Michel Journal of Heterocyclic Chemistry, 2005 , vol. 42, # 5 p. 991 - 994

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4-[5-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,3,4-thiadiazolidin-2-ylidene]cyclohexa-2,5-dien-1-one Structure

4-[5-(4-oxocycl...

CAS#:88203-23-0

Literature: Jensen,K.A.; Pedersen,C. Acta Chemica Scandinavica (1947-1973), 1961 , vol. 15, p. 1124 - 1129

 Precursor & DownStream

Precursor  2

DownStream  0

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