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16778-84-0,MFCD00060379
Catalog No.:AA001XIW

16778-84-0 | Benzoyl isothiocyanate, 4-methoxy-

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
97%
in stock  
$80.00   $56.00
- +
1g
97%
in stock  
$156.00   $109.00
- +
5g
97%
in stock  
$305.00   $214.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA001XIW
Chemical Name:
Benzoyl isothiocyanate, 4-methoxy-
CAS Number:
16778-84-0
Molecular Formula:
C9H7NO2S
Molecular Weight:
193.2224
MDL Number:
MFCD00060379
SMILES:
COc1ccc(cc1)C(=O)N=C=S
Properties
Computed Properties
 
Complexity:
228  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
13  
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:
3.2  

Literature
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SDS
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Tags:16778-84-0 Molecular Formula|16778-84-0 MDL|16778-84-0 SMILES|16778-84-0 Benzoyl isothiocyanate, 4-methoxy-
Catalog No.: AA001XIW
16778-84-0,MFCD00060379
16778-84-0 | Benzoyl isothiocyanate, 4-methoxy-
Pack Size： 250mg
Purity： 97%
in stock
$80.00 $56.00
Pack Size： 1g
Purity： 97%
in stock
$156.00 $109.00
Pack Size： 5g
Purity： 97%
in stock
$305.00 $214.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA001XIW
Chemical Name: Benzoyl isothiocyanate, 4-methoxy-
CAS Number: 16778-84-0
Molecular Formula: C9H7NO2S
Molecular Weight: 193.2224
MDL Number: MFCD00060379
SMILES: COc1ccc(cc1)C(=O)N=C=S
Properties
Complexity: 228  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 13  
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: 3.2  
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