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Home Other Building Blocks 4-Hydroxyphenoxyacetic acid

4-Hydroxyphenoxyacetic acid

CAS No.:
1878-84-8
Catalog Number:
AG002GHQ
Molecular Formula:
C8H8O4
Molecular Weight:
168.1467
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$50
- +
5g
95%
In Stock USA
United States
$150
- +
25g
95%
In Stock USA
United States
$525
- +
Product Description
Catalog Number:
AG002GHQ
Chemical Name:
4-Hydroxyphenoxyacetic acid
CAS Number:
1878-84-8
Molecular Formula:
C8H8O4
Molecular Weight:
168.1467
MDL Number:
MFCD00014362
IUPAC Name:
2-(4-hydroxyphenoxy)acetic acid
InChI:
InChI=1S/C8H8O4/c9-6-1-3-7(4-2-6)12-5-8(10)11/h1-4,9H,5H2,(H,10,11)
InChI Key:
PKGWLCZTTHWKIZ-UHFFFAOYSA-N
SMILES:
OC(=O)COc1ccc(cc1)O
EC Number:
217-525-8
Properties
Complexity:
149  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.042g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
168.148g/mol
Monoisotopic Mass:
168.042g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Literature
Title Journal
Design, synthesis, and evaluation of postulated transient intermediate and substrate analogues as inhibitors of 4-hydroxyphenylpyruvate dioxygenase. Bioorganic & medicinal chemistry letters 20020708
Properties