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362601-74-9,MFCD03093788
Catalog No.:AA007A5L

362601-74-9 | 1-Methoxy-prop-2-yl isothiocyanate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$151.00   $106.00
- +
1g
95%
in stock  
$381.00   $267.00
- +
5g
95%
in stock  
$1,607.00   $1,125.00
- +
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  • Technical Information
  • Properties
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Technical Information
Catalog Number:
AA007A5L
Chemical Name:
1-Methoxy-prop-2-yl isothiocyanate
CAS Number:
362601-74-9
Molecular Formula:
C5H9NOS
Molecular Weight:
131.1961
MDL Number:
MFCD03093788
SMILES:
CC(N=C=S)COC
Properties
Computed Properties
 
Complexity:
98.6  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
1  
XLogP3:
1.9  

Literature

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:362601-74-9 Molecular Formula|362601-74-9 MDL|362601-74-9 SMILES|362601-74-9 1-Methoxy-prop-2-yl isothiocyanate