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Home Other Building Blocks (2,4-Dimethylphenoxy)acetic acid

(2,4-Dimethylphenoxy)acetic acid

CAS No.:
13334-49-1
Catalog Number:
AG0014PD
Molecular Formula:
C10H12O3
Molecular Weight:
180.2005
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$25
- +
5g
95%
In Stock USA
United States
$94
- +
25g
95%
In Stock USA
United States
$375
- +
Product Description
Catalog Number:
AG0014PD
Chemical Name:
(2,4-Dimethylphenoxy)acetic acid
CAS Number:
13334-49-1
Molecular Formula:
C10H12O3
Molecular Weight:
180.2005
MDL Number:
MFCD00014355
IUPAC Name:
2-(2,4-dimethylphenoxy)acetic acid
InChI:
InChI=1S/C10H12O3/c1-7-3-4-9(8(2)5-7)13-6-10(11)12/h3-5H,6H2,1-2H3,(H,11,12)
InChI Key:
XRTZHWXWLUGOAT-UHFFFAOYSA-N
SMILES:
OC(=O)COc1ccc(cc1C)C
EC Number:
236-385-9
NSC Number:
408598
Properties
Complexity:
179  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.079g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
180.203g/mol
Monoisotopic Mass:
180.079g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Identification of auxins by a chemical genomics approach. Journal of experimental botany 20080701
Properties