2-amino-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile

Modify Date: 2025-09-11 18:08:27

2-amino-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile Structure
2-amino-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile structure
Common Name 2-amino-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
CAS Number 42159-76-2 Molecular Weight 234.36000
Density 1.13g/cm3 Boiling Point 405.5ºC at 760 mmHg
Molecular Formula C13H18N2S Melting Point N/A
MSDS N/A Flash Point 199ºC

 Names

Name 2-amino-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.13g/cm3
Boiling Point 405.5ºC at 760 mmHg
Molecular Formula C13H18N2S
Molecular Weight 234.36000
Flash Point 199ºC
Exact Mass 234.11900
PSA 78.05000
LogP 3.93418
Index of Refraction 1.573
InChIKey QDIYAWBTKKYATE-UHFFFAOYSA-N
SMILES CC(C)(C)C1CCc2c(sc(N)c2C#N)C1
Storage condition 2-8°C

 Safety Information

HS Code 2934999090

 Precursor & DownStream

Precursor  1

DownStream  0

 Customs

HS Code 2934999090
Summary 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Bioassay

View more

Name: Cell survival assay for modulators of telomere damage signalling
Source: 15378
Target: N/A
External Id: TELO_02
Name: Discovery of Small Molecules to Inhibit Human Cytomegalovirus Nuclear Egress
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
Target: HCMV UL50
External Id: HMS1262
Name: qHTS assay for inhibitors of human lactate dehydrogenase
Source: NCGC
Target: N/A
External Id: LDHA
Name: Binding affinity to substrate binding site of multidrug resistance Mycobacterium tube...
Source: ChEMBL
Target: Diacylglycerol acyltransferase/mycolyltransferase Ag85C
External Id: CHEMBL1634179
Name: Primary qHTS Assay for Foot and Mouth Disease Virus Antivirals against NCGC Sytravon ...
Source: NCGC
External Id: stopgo-p2-SytraCBC-dual-FF
Name: A screen for compounds that inhibit the activity of LtaS in Staphylococcus aureus
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
External Id: HMS979
Name: Alphascreen assay for small molecules abrogating mHTT-CaM Interaction
Source: 24983
Target: Huntingtin
External Id: KUHTS-Muma KU-CaM-Htt INH-01
Name: Primary qHTS Assay for Foot and Mouth Disease Virus Antivirals against NCGC Sytravon ...
Source: NCGC
External Id: stopgo-p2-SytraCBC-dual-Ren
Name: Growth inhibition of Mycobacterium smegmatis
Source: ChEMBL
Target: Mycolicibacterium smegmatis
External Id: CHEMBL1634181
Name: A screen for compounds that inhibit viral RNA polymerase binding and polymerization a...
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
Target: Chain A, Poliovirus Polymerase With Gtp
External Id: HMS750
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 Synonyms

MFCD00128283
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