18856-63-8,MFCD00041101
Catalog No.:AA002GX9

18856-63-8 | 4-Ethylphenyl isothiocyanate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
in stock  
$181.00   $127.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA002GX9
Chemical Name:
4-Ethylphenyl isothiocyanate
CAS Number:
18856-63-8
Molecular Formula:
C9H9NS
Molecular Weight:
163.2395
MDL Number:
MFCD00041101
SMILES:
CCc1ccc(cc1)N=C=S
Properties
Properties
 
BP:
245 °C(lit.)  
Form:
Liquid  
Refractive Index:
n20/D 1.62(lit.)  
Stability:
Moisture Sensitive  

Computed Properties
 
Complexity:
153  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
4.4  

Downstream Synthesis Route
29022-11-5    18856-63-8    180181-93-5   
2-{2-(Z)-4-Ethyl-phenylimino-6-oxo-4-phenyl-tetrahydro-pyrimidin-1-yl}-acetamide 

[1]TetrahedronLetters,2005,vol.46,p.5747-5750

[1]Patent:US2008/267912,2008,A1.Locationinpatent:Page/Pagecolumn30;32

144-82-1    18856-63-8   
4-(4-ethylphenyl)carbamothioylamino}-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide 

[1]Phosphorus,SulfurandSiliconandtheRelatedElements,2018,vol.193,p.528-534

[1]CurrentPatentAssignee:CHINESEACADEMYOFMEDICALSCIENCES-CN115466271,2022,ALocationinpatent:Paragraph0094-0096

Literature
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SDS
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Tags:18856-63-8 Molecular Formula|18856-63-8 MDL|18856-63-8 SMILES|18856-63-8 4-Ethylphenyl isothiocyanate
Catalog No.: AA002GX9
18856-63-8,MFCD00041101
18856-63-8 | 4-Ethylphenyl isothiocyanate
Pack Size: 5g
Purity:
in stock
$181.00 $127.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA002GX9
Chemical Name: 4-Ethylphenyl isothiocyanate
CAS Number: 18856-63-8
Molecular Formula: C9H9NS
Molecular Weight: 163.2395
MDL Number: MFCD00041101
SMILES: CCc1ccc(cc1)N=C=S
Properties
BP: 245 °C(lit.)  
Form: Liquid  
Refractive Index: n20/D 1.62(lit.)  
Stability: Moisture Sensitive  
Complexity: 153  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 11  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 4.4  
Downstream Synthesis Route
29022-11-5    18856-63-8    180181-93-5   
2-{2-(Z)-4-Ethyl-phenylimino-6-oxo-4-phenyl-tetrahydro-pyrimidin-1-yl}-acetamide 

[1]TetrahedronLetters,2005,vol.46,p.5747-5750

279236-77-0    18856-63-8    25952-53-8    1073243-01-2 

[1]Patent:US2008/267912,2008,A1.Locationinpatent:Page/Pagecolumn30;32

144-82-1    18856-63-8   
4-(4-ethylphenyl)carbamothioylamino}-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide 

[1]Phosphorus,SulfurandSiliconandtheRelatedElements,2018,vol.193,p.528-534

18856-63-8    476-28-8    2888543-30-2 

[1]CurrentPatentAssignee:CHINESEACADEMYOFMEDICALSCIENCES-CN115466271,2022,ALocationinpatent:Paragraph0094-0096

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