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1000520-92-2,MFCD09832241
Catalog No.:AA0000M6
1000520-92-2 | Benzeneacetic acid, 4-fluoro-3-methyl-
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Purity
Availability
Price(USD)
Quantity
  
1g
95%
1 week  
$90.00
- +
5g
95%
1 week  
$190.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA0000M6
Chemical Name:
Benzeneacetic acid, 4-fluoro-3-methyl-
CAS Number:
1000520-92-2
Molecular Formula:
C9H9FO2
Molecular Weight:
168.1650
MDL Number:
MFCD09832241
IUPAC Name:
2-(4-fluoro-3-methylphenyl)acetic acid
InChI:
InChI=1S/C9H9FO2/c1-6-4-7(5-9(11)12)2-3-8(6)10/h2-4H,5H2,1H3,(H,11,12)
InChI Key:
VZDGZGNZGMJNPR-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1ccc(c(c1)C)F
Properties
Computed Properties
 
Complexity:
170  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.059g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
168.167g/mol
Monoisotopic Mass:
168.059g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

Synonyms
 
1000520-92-2 
2-(4-fluoro-3-methylphenyl)acetic acid 
SBB088168 
ZINC31893035 
(4-Fluoro-3-methylphenyl)acetic acid 
AKOS011681040 
Benzeneacetic acid, 4-fluoro-3-methyl- 
AJ-84440 
AS-46348 
SC-12836 
FT-0704044 
4-Fluoro-3-methylphenylaceticacid 
4-FLUORO-3-METHYLPHENYLACETIC ACID 
MFCD09832241 
SCHEMBL1699671 
CTK7J2265 
KS-00000YNB 
DTXSID40653458 
VZDGZGNZGMJNPR-UHFFFAOYSA-N 
4-fluoro-3-methylphenylacetic aicd 
Literature
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