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1975-53-7,MFCD14582960
Catalog No.:AA002ARQ

1975-53-7 | 4-Cyano-2-methylbenzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$20.00   $14.00
- +
5g
98%
in stock  
$79.00   $56.00
- +
10g
95%
in stock  
$151.00   $106.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA002ARQ
Chemical Name:
4-Cyano-2-methylbenzoic acid
CAS Number:
1975-53-7
Molecular Formula:
C9H7NO2
Molecular Weight:
161.1574
MDL Number:
MFCD14582960
SMILES:
N#Cc1ccc(c(c1)C)C(=O)O
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:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.5  

Literature
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SDS
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Tags:1975-53-7 Molecular Formula|1975-53-7 MDL|1975-53-7 SMILES|1975-53-7 4-Cyano-2-methylbenzoic acid
Catalog No.: AA002ARQ
1975-53-7,MFCD14582960
1975-53-7 | 4-Cyano-2-methylbenzoic acid
Pack Size： 1g
Purity： 98%
in stock
$20.00 $14.00
Pack Size： 5g
Purity： 98%
in stock
$79.00 $56.00
Pack Size： 10g
Purity： 95%
in stock
$151.00 $106.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA002ARQ
Chemical Name: 4-Cyano-2-methylbenzoic acid
CAS Number: 1975-53-7
Molecular Formula: C9H7NO2
Molecular Weight: 161.1574
MDL Number: MFCD14582960
SMILES: N#Cc1ccc(c(c1)C)C(=O)O
Properties
Complexity: 228  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 12  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.5  
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