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3288-04-8,MFCD00011675
Catalog No.:AA003HHM

3288-04-8 | 2-Methoxyphenyl isothiocyanate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%(GC)
in stock  
$34.00   $24.00
- +
5g
>98.0%(GC)
in stock  
$77.00   $54.00
- +
25g
>98.0%(GC)
in stock  
$231.00   $162.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA003HHM
Chemical Name:
2-Methoxyphenyl isothiocyanate
CAS Number:
3288-04-8
Molecular Formula:
C8H7NOS
Molecular Weight:
165.2123
MDL Number:
MFCD00011675
SMILES:
S=C=Nc1ccccc1OC
Properties
Properties
 
BP:
264-266 °C  
Form:
Liquid  
Refractive Index:
1.6433-1.6453  
Stability:
Moisture Sensitive  
Storage:
2-8℃;Inert atmosphere;  

Computed Properties
 
Complexity:
166  
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:
3  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
3.3  

Literature

Title: 2-Methoxyphenyl isocyanate and 2-Methoxyphenyl isothiocyanate: conformers, vibration structure and multiplet Fermi resonance.

Journal: Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20120601

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

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SDS
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Tags:3288-04-8 Molecular Formula|3288-04-8 MDL|3288-04-8 SMILES|3288-04-8 2-Methoxyphenyl isothiocyanate
Catalog No.: AA003HHM
3288-04-8,MFCD00011675
3288-04-8 | 2-Methoxyphenyl isothiocyanate
Pack Size： 1g
Purity： 98%(GC)
in stock
$34.00 $24.00
Pack Size： 5g
Purity： >98.0%(GC)
in stock
$77.00 $54.00
Pack Size： 25g
Purity： >98.0%(GC)
in stock
$231.00 $162.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA003HHM
Chemical Name: 2-Methoxyphenyl isothiocyanate
CAS Number: 3288-04-8
Molecular Formula: C8H7NOS
Molecular Weight: 165.2123
MDL Number: MFCD00011675
SMILES: S=C=Nc1ccccc1OC
Properties
BP: 264-266 °C  
Form: Liquid  
Refractive Index: 1.6433-1.6453  
Stability: Moisture Sensitive  
Storage: 2-8℃;Inert atmosphere;  
Complexity: 166  
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: 3  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 3.3  
Literature fold

Title: 2-Methoxyphenyl isocyanate and 2-Methoxyphenyl isothiocyanate: conformers, vibration structure and multiplet Fermi resonance.

Journal: Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy20120601

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters20101101

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