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Home Other Building Blocks 2-Chloro-3',4'-dihydroxyacetophenone

2-Chloro-3',4'-dihydroxyacetophenone

CAS No.:
99-40-1
Catalog Number:
AG0036QY
Molecular Formula:
C8H7ClO3
Molecular Weight:
186.5924
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$19
- +
25g
98%
In Stock USA
United States
$23
- +
100g
98%
In Stock USA
United States
$63
- +
500g
98%
In Stock USA
United States
$300
- +
Product Description
Catalog Number:
AG0036QY
Chemical Name:
2-Chloro-3',4'-dihydroxyacetophenone
CAS Number:
99-40-1
Molecular Formula:
C8H7ClO3
Molecular Weight:
186.5924
MDL Number:
MFCD00002200
IUPAC Name:
2-chloro-1-(3,4-dihydroxyphenyl)ethanone
InChI:
InChI=1S/C8H7ClO3/c9-4-8(12)5-1-2-6(10)7(11)3-5/h1-3,10-11H,4H2
InChI Key:
LWTJEJCZJFZKEL-UHFFFAOYSA-N
SMILES:
ClCC(=O)c1ccc(c(c1)O)O
EC Number:
202-754-8
UNII:
FN6949L56Q
Properties
Complexity:
172  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.008g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
186.591g/mol
Monoisotopic Mass:
186.008g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Literature
Title Journal
An efficient and selective way to new highly functionalized coronands or spiro derivatives using ultrasonic irradiation. Ultrasonics sonochemistry 20120501
alpha-bromoacetophenone derivatives as neutral protein tyrosine phosphatase inhibitors: structure-Activity relationship. Bioorganic & medicinal chemistry letters 20021104
Properties