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1,3-Benzodithiole,2-(1,3-benzodithiol-2-ylidene)-

Catalog Number
ACM24648133
CAS Number
24648-13-3
Product Name
1,3-Benzodithiole,2-(1,3-benzodithiol-2-ylidene)-
Structure
Category
Organic Field Effect Transistor (OFET) Materials
Synonyms
1,3-Benzodithiole,2-(1,3-benzodithiol-2-ylidene)-;[2,2]Bi[benzo[1,3]dithiolylidene],DB-TTF;Dibenzotetrathiafulvalene;Δ2,2-Bi(1,3-benzodithiol);Δ2,2-Bi[1,3-benzodithiole];Δ2,2-Bi[4,5-(1,3-butadiene-1,4-diyl)-1,3-dithiol];Δ2,2-Bi[4,5-[1,3]butadieno-1,3-dith
IUPAC Name
2-(1,3-benzodithiol-2-ylidene)-1,3-benzodithiole
Molecular Weight
304.5g/mol
Molecular Formula
C14H8S4
Canonical SMILES
C1=CC=C2C(=C1)SC(=C3SC4=CC=CC=C4S3)S2
InChI
InChI=1S/C14H8S4/c1-2-6-10-9(5-1)15-13(16-10)14-17-11-7-3-4-8-12(11)18-14/h1-8H
InChI Key
OVIRUXIWCFZJQC-UHFFFAOYSA-N
Complexity
299
Covalently-Bonded Unit Count
1
Exact Mass
303.950885g/mol
Formal Charge
0
Heavy Atom Count
18
MeSH Entry Terms
1,3-benzodithiole, 2-(1,3-benzodithiol-2-ylidene)-;2-(1,3-benzodithiol-2-ylidene)-1,3-benzodithiole;DBTTF;dibenzo-tetra-thia-fulvalene;dibenzo-tetrathiafulvalene;dibenzotetra-thia-fulvalene;dibenzotetrathiafulvalene
Monoisotopic Mass
303.950885g/mol
NSC Number
623559
Rotatable Bond Count
0
XLogP3
5.4
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