Home Other Building Blocks 4481-27-0
4481-27-0,MFCD20645804
Catalog No.:AA00I8E4

4481-27-0 | 3-Formyl-5-methylbenzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
96%
in stock  
$594.00   $416.00
- +
5g
96%
in stock  
$1,758.00   $1,231.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00I8E4
Chemical Name:
3-Formyl-5-methylbenzoic acid
CAS Number:
4481-27-0
Molecular Formula:
C9H8O3
Molecular Weight:
164.1580
MDL Number:
MFCD20645804
SMILES:
O=Cc1cc(C)cc(c1)C(=O)O
Properties
Computed Properties
 
Complexity:
188  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
1.3  

Downstream Synthesis Route

[1]ACSMedicinalChemistryLetters,2013,vol.4,p.113-117

Literature
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SDS
Tags:4481-27-0 Molecular Formula|4481-27-0 MDL|4481-27-0 SMILES|4481-27-0 3-Formyl-5-methylbenzoic acid