Home Carboxys 2,3-Dihydro-1-benzofuran-2-carboxylic acid

2,3-Dihydro-1-benzofuran-2-carboxylic acid

CAS No.:
1914-60-9
Catalog Number:
AG002F7P
Molecular Formula:
C9H8O3
Molecular Weight:
164.1580
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$69
- +
5g
98%
In Stock USA
United States
$207
- +
10g
98%
In Stock USA
United States
$382
- +
25g
98%
In Stock USA
United States
$750
- +
100g
98%
In Stock USA
United States
$2100
- +
Product Description
Catalog Number:
AG002F7P
Chemical Name:
2,3-Dihydro-1-benzofuran-2-carboxylic acid
CAS Number:
1914-60-9
Molecular Formula:
C9H8O3
Molecular Weight:
164.1580
MDL Number:
MFCD03086168
IUPAC Name:
2,3-dihydro-1-benzofuran-2-carboxylic acid
InChI:
InChI=1S/C9H8O3/c10-9(11)8-5-6-3-1-2-4-7(6)12-8/h1-4,8H,5H2,(H,10,11)
InChI Key:
WEVFUSSJCGAVOH-UHFFFAOYSA-N
SMILES:
OC(=O)C1Cc2c(O1)cccc2
Properties
Complexity:
190  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.047g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
164.16g/mol
Monoisotopic Mass:
164.047g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties