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Home Other Building Blocks (2-Isopropyl-5-methylphenoxy)acetic acid

(2-Isopropyl-5-methylphenoxy)acetic acid

CAS No.:
5333-40-4
Catalog Number:
AG003ES4
Molecular Formula:
C12H16O3
Molecular Weight:
208.2536
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$37
- +
5g
97%
In Stock USA
United States
$150
- +
25g
97%
In Stock USA
United States
$525
- +
Product Description
Catalog Number:
AG003ES4
Chemical Name:
(2-Isopropyl-5-methylphenoxy)acetic acid
CAS Number:
5333-40-4
Molecular Formula:
C12H16O3
Molecular Weight:
208.2536
MDL Number:
MFCD00021757
IUPAC Name:
2-(5-methyl-2-propan-2-ylphenoxy)acetic acid
InChI:
InChI=1S/C12H16O3/c1-8(2)10-5-4-9(3)6-11(10)15-7-12(13)14/h4-6,8H,7H2,1-3H3,(H,13,14)
InChI Key:
MURZAHIYMVFXCF-UHFFFAOYSA-N
SMILES:
OC(=O)COc1cc(C)ccc1C(C)C
NSC Number:
2403
Properties
Complexity:
213  
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:
4  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties