Home Other Building Blocks 4,6-Dihydroxyisophthalic acid

4,6-Dihydroxyisophthalic acid

CAS No.:
19829-74-4
Catalog Number:
AG002BEZ
Molecular Formula:
C8H6O6
Molecular Weight:
198.1296
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$42
- +
5g
95%
In Stock USA
United States
$143
- +
Product Description
Catalog Number:
AG002BEZ
Chemical Name:
4,6-Dihydroxyisophthalic acid
CAS Number:
19829-74-4
Molecular Formula:
C8H6O6
Molecular Weight:
198.1296
MDL Number:
MFCD08693472
IUPAC Name:
4,6-dihydroxybenzene-1,3-dicarboxylic acid
InChI:
InChI=1S/C8H6O6/c9-5-2-6(10)4(8(13)14)1-3(5)7(11)12/h1-2,9-10H,(H,11,12)(H,13,14)
InChI Key:
MZGVIIXFGJCRDR-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(C(=O)O)c(cc1O)O
Properties
Complexity:
226  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.016g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
198.13g/mol
Monoisotopic Mass:
198.016g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
115A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties