UDI

butane-1,4-dithiol

Created:	2023-02-01
Last modified:	2024-09-27

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1 entries where UDI is covalently linked to polymer or other heterogen groups

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Chemical Details
Formal Charge	0
Atom Count	16
Chiral Atom Count	0
Bond Count	15
Aromatic Bond Count	0

2D diagram of UDI

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Chemical Component Summary
Name	butane-1,4-dithiol
Synonyms	1,2-dithiane 1-oxide (reacted)
Systematic Name (OpenEye OEToolkits)	butane-1,4-dithiol
Formula	C₄ H₁₀ S₂
Molecular Weight	122.252
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	SCCCCS
SMILES	OpenEye OEToolkits	2.0.7	C(CCS)CS
Canonical SMILES	CACTVS	3.385	SCCCCS
Canonical SMILES	OpenEye OEToolkits	2.0.7	C(CCS)CS
InChI	InChI	1.06	InChI=1S/C4H10S2/c5-3-1-2-4-6/h5-6H,1-4H2
InChIKey	InChI	1.06	SMTOKHQOVJRXLK-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	79148
CCDC/CSD	QEKYAG

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