Home Carboxes 916911-66-5
916911-66-5,MFCD14695264
Catalog No.:AA01B93Z
916911-66-5 | 2-[3-(2-methylpropoxy)phenyl]acetic acid
Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95.0%
3 weeks  
$194.00
- +
250mg
95.0%
3 weeks  
$260.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Q & A
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA01B93Z
Chemical Name:
2-[3-(2-methylpropoxy)phenyl]acetic acid
CAS Number:
916911-66-5
Molecular Formula:
C12H16O3
Molecular Weight:
208.2536
MDL Number:
MFCD14695264
IUPAC Name:
2-[3-(2-methylpropoxy)phenyl]acetic acid
InChI:
InChI=1S/C12H16O3/c1-9(2)8-15-11-5-3-4-10(6-11)7-12(13)14/h3-6,9H,7-8H2,1-2H3,(H,13,14)
InChI Key:
FHYDGAOWKXCFHT-UHFFFAOYSA-N
SMILES:
CC(COc1cccc(c1)CC(=O)O)C
Properties
Computed Properties
 
Complexity:
201  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.11g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
208.257g/mol
Monoisotopic Mass:
208.11g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

Synonyms
 
2-[3-(2-methylpropoxy)phenyl]acetic Acid 
916911-66-5 
SCHEMBL11805244 
MFCD14695264 
ZINC42417259 
AKOS010657992 
A1-11580 
CID11975052 
Literature
Quotation Request
Company Name:
*
Contact Person:
*
Email:
*
Quantity Required:
*
Additional Info:
Q & A