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330196-48-0,MFCD00832021
Catalog No.:AA00VVXM

330196-48-0 | 4-chloro-2-[(2E)-1-methyl-2,3-dihydro-1H-1,3-benzodiazol-2-ylidene]-3-oxobutanenitrile

Pack Size
Purity
Availability
Price(USD)
Quantity
  
50mg
95%
3 weeks  
$250.00   $175.00
- +
100mg
95%
3 weeks  
$317.00   $222.00
- +
250mg
95%
3 weeks  
$404.00   $283.00
- +
500mg
95%
3 weeks  
$668.00   $468.00
- +
1g
95%
3 weeks  
$854.00   $598.00
- +
2.5g
95%
3 weeks  
$1,561.00   $1,093.00
- +
5g
95%
3 weeks  
$2,256.00   $1,579.00
- +
10g
95%
3 weeks  
$3,290.00   $2,303.00
- +
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Technical Information
Catalog Number:
AA00VVXM
Chemical Name:
4-chloro-2-[(2E)-1-methyl-2,3-dihydro-1H-1,3-benzodiazol-2-ylidene]-3-oxobutanenitrile
CAS Number:
330196-48-0
Molecular Formula:
C12H10ClN3O
Molecular Weight:
247.6803
MDL Number:
MFCD00832021
SMILES:
ClCC(=O)/C(=c/1\[nH]c2c(n1C)cccc2)/C#N
Properties
Computed Properties
 
Complexity:
373  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
Undefined Bond Stereocenter Count:
1  
XLogP3:
1.5  

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Additional Info:
SDS
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Tags:330196-48-0 Molecular Formula|330196-48-0 MDL|330196-48-0 SMILES|330196-48-0 4-chloro-2-[(2E)-1-methyl-2,3-dihydro-1H-1,3-benzodiazol-2-ylidene]-3-oxobutanenitrile