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2,3':4',2''-Terthiophene

HCID 395534
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Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
101306-11-0
Standard SMILES
c1csc(-c2cscc2-c2cccs2)c1
InChIKey
XMTNPHVYRJHQFV-UHFFFAOYSA-N
Molecular formula
C12H8S3
Average molar mass
248.4 g/mol
Monoisotopic mass
247.97881378

Overview

2,3':4',2''-terthiophene is a terthiophene.

Names & identifiers

Preferred name
2,3':4',2''-Terthiophene
IUPAC
3,4-dithiophen-2-ylthiophene
English name
2,3':4',2''-terthiophene
Molecular formula
C12H8S3
Molecular weight
248.39

Names & synonyms

2,3':4',2''-Terthiophene101306-11-0CHEBI:50089DTXSID00327901RefChem:81150DTXCID002790123,4-dithiophen-2-ylthiopheneMFCD011063414'-(thiophen-2-yl)-2,3'-bithiopheneNSC7002253,4-bis(2-thienyl)thiophene2,3:4,2-TErthiophene
Show more names
SCHEMBL9536952CHEMBL1968714SCHEMBL22734783AKOS024368117NSC-7002252-(4-(2-thienyl)-3-thienyl)thiopheneAS-58256NCI60_035959

Database identifiers

CAS
101306-11-0
PubChem CID
395534
DTXSID
DTXSID00327901
ChEMBL
CHEMBL1968714
ChEBI
CHEBI:50089
Nikkaji
J1.587.919J

Properties

Computed structural properties

XLogP
4.3
Topological polar surface area
84.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
15
Formal charge
0
Complexity
197

Physicochemical properties

Melting point
64 °C · 64 °C
Boiling point
217 °C · 217 °C(Press: 17 Torr)
Density
1.318 · 1.318±0.06 g/cm3(Predicted)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
280 · P280-P305+P351+P338

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

Chemistry & industry

Suppliers7 total

吉林中科研伸科技有限公司18143011203 · [email protected]
北京建强伟业科技有限公司(FUSION弗珍试剂品牌)0531-88924771 15614660963 · [email protected]
苏州美石生物科技有限公司1173954148q · [email protected]
郑州汇聚化工有限公司0371-55900031 18137872243 · [email protected]
药明览博(武汉)化学科技有限公司022-59987777 13552403979 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 19370895928 · [email protected]
上海凯为化学科技有限公司021-58461859 15821823057 · [email protected]

Additional notes

DefinitionChEBI: 2,3':4',2''-terthiophene is a terthiophene.

Related reactions

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Compound notes

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