Home Carboxys 3-(tert-Butoxy)benzenecarboxylic acid

3-(tert-Butoxy)benzenecarboxylic acid

CAS No.:
15360-02-8
Catalog Number:
AG007XZ2
Molecular Formula:
C11H14O3
Molecular Weight:
194.2271
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Purity
Availability
Location
Price(USD)
Quantity
  
1g
≥95%
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United States
$311
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Product Description
Catalog Number:
AG007XZ2
Chemical Name:
3-(tert-Butoxy)benzenecarboxylic acid
CAS Number:
15360-02-8
Molecular Formula:
C11H14O3
Molecular Weight:
194.2271
MDL Number:
MFCD03412397
IUPAC Name:
3-[(2-methylpropan-2-yl)oxy]benzoic acid
InChI:
InChI=1S/C11H14O3/c1-11(2,3)14-9-6-4-5-8(7-9)10(12)13/h4-7H,1-3H3,(H,12,13)
InChI Key:
IURSJORDCNZJFE-UHFFFAOYSA-N
SMILES:
OC(=O)c1cccc(c1)OC(C)(C)C
Properties
Complexity:
205  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.094g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
194.23g/mol
Monoisotopic Mass:
194.094g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties