Basic Description

Synonyms	DTXSID701006101 \| UNII-Q22S9Y993E \| [4-(selenocyanatomethyl)phenyl]methyl selenocyanate \| 1,4-Phenylenebis(methylene)selenocyanate \| SCHEMBL3546615 \| BDBM50252421 \| (1,4-Phenylene)bis(methylene) bis(selenocyanate) \| Q22S9Y993E \| BRN 3283843 \| Selenocyanic
Specifications & Purity	≥99%
Source	Synthetic
Storage Temp	Store at 2-8°C
Shipped In	Wet ice
Product Description	Store at +4°C. The product can be stored for up to 12 months.

Associated Targets(Human)

CYP1A2 Tchem Cytochrome P450 1A2 (1 Activities)

Discover Target: CYP1A2

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

CYP1B1 Tchem Cytochrome P450 1B1 (1 Activities)

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Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

CYP1A1 Tchem Cytochrome P450 1A1 (1 Activities)

Discover Target: CYP1A1

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

CYP1B1 Tchem Cytochrome P450 1B1 (1148 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

CYP1A1 Tchem Cytochrome P450 1A1 (1169 Activities)

Discover Target: CYP1A1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

CYP1A2 Tchem Cytochrome P450 1A2 (26471 Activities)

Discover Target: CYP1A2

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

LNCaP (8286 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Associated Targets(non-human)

V79 (1637 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

IUPAC Name	[4-(selenocyanatomethyl)phenyl]methyl selenocyanate
INCHI	InChI=1S/C10H8N2Se2/c11-7-13-5-9-1-2-10(4-3-9)6-14-8-12/h1-4H,5-6H2
InChi Key	QFTBWTJGZHUOAW-UHFFFAOYSA-N
Canonical SMILES	C1=CC(=CC=C1C[Se]C#N)C[Se]C#N
Isomeric SMILES	C1=CC(=CC=C1C[Se]C#N)C[Se]C#N
PubChem CID	5708
Molecular Weight	314.1

Certificates

Certificate of Analysis(COA)

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Chemical and Physical Properties

Solubility	Soluble in DMSO

References

1. Zheng W et al.. (2019) Extracellular Albumin Covalently Sequesters Selenocompounds and Determines Cytotoxicity.. Int J Mol Sci, 20 (19): [PMID:31554226]
2. Tsoi H et al.. (2021) Targeting the IL-6/STAT3 Signalling Cascade to Reverse Tamoxifen Resistance in Estrogen Receptor Positive Breast Cancer.. Cancers (Basel), 13 (7): [PMID:33806019]

Solution Calculators

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p-Xyleneselenocyanate (1,4-Phenylenebis(methylene)selenocyanate) - ≥99%, high purity , CAS No.85539-83-9