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Home Other Building Blocks Methyl 2-(3,5-dihydroxyphenyl)acetate

Methyl 2-(3,5-dihydroxyphenyl)acetate

CAS No.:
4724-10-1
Catalog Number:
AG003RQI
Molecular Formula:
C9H10O4
Molecular Weight:
182.1733
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
1 week
United States
$87
- +
1g
98%
1 week
United States
$132
- +
5g
98%
1 week
United States
$371
- +
25g
98%
1 week
United States
$1371
- +
Product Description
Catalog Number:
AG003RQI
Chemical Name:
Methyl 2-(3,5-dihydroxyphenyl)acetate
CAS Number:
4724-10-1
Molecular Formula:
C9H10O4
Molecular Weight:
182.1733
MDL Number:
MFCD00091620
IUPAC Name:
methyl 2-(3,5-dihydroxyphenyl)acetate
InChI:
InChI=1S/C9H10O4/c1-13-9(12)4-6-2-7(10)5-8(11)3-6/h2-3,5,10-11H,4H2,1H3
InChI Key:
LMLSBPHXMGSGCR-UHFFFAOYSA-N
SMILES:
COC(=O)Cc1cc(O)cc(c1)O
Properties
Complexity:
171  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.058g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
182.175g/mol
Monoisotopic Mass:
182.058g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Literature
Title Journal
Combining hit identification strategies: fragment-based and in silico approaches to orally active 2-aminothieno[2,3-d]pyrimidine inhibitors of the Hsp90 molecular chaperone. Journal of medicinal chemistry 20090813
Properties