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871116-91-5,MFCD18204796
Catalog No.:AA01DD96

871116-91-5 | 2-(3-Bromo-5-methylphenyl)acetonitrile

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
in stock  
$366.00   $256.00
- +
1g
in stock  
$980.00   $686.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA01DD96
Chemical Name:
2-(3-Bromo-5-methylphenyl)acetonitrile
CAS Number:
871116-91-5
Molecular Formula:
C9H8BrN
Molecular Weight:
210.0705
MDL Number:
MFCD18204796
SMILES:
N#CCc1cc(C)cc(c1)Br
Properties
Computed Properties
 
Complexity:
170  
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:
1  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.6  

Literature
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SDS
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Tags:871116-91-5 Molecular Formula|871116-91-5 MDL|871116-91-5 SMILES|871116-91-5 2-(3-Bromo-5-methylphenyl)acetonitrile
Catalog No.: AA01DD96
871116-91-5,MFCD18204796
871116-91-5 | 2-(3-Bromo-5-methylphenyl)acetonitrile
Pack Size： 250mg
Purity：
in stock
$366.00 $256.00
Pack Size： 1g
Purity：
in stock
$980.00 $686.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA01DD96
Chemical Name: 2-(3-Bromo-5-methylphenyl)acetonitrile
CAS Number: 871116-91-5
Molecular Formula: C9H8BrN
Molecular Weight: 210.0705
MDL Number: MFCD18204796
SMILES: N#CCc1cc(C)cc(c1)Br
Properties
Complexity: 170  
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: 1  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.6  
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