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Home Other Building Blocks 2,5-Dimethylterephthalic acid

2,5-Dimethylterephthalic acid

CAS No.:
6051-66-7
Catalog Number:
AG003G08
Molecular Formula:
C10H10O4
Molecular Weight:
194.1840
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$78
- +
5g
96%
In Stock USA
United States
$233
- +
25g
96%
In Stock USA
United States
$928
- +
Product Description
Catalog Number:
AG003G08
Chemical Name:
2,5-Dimethylterephthalic acid
CAS Number:
6051-66-7
Molecular Formula:
C10H10O4
Molecular Weight:
194.1840
MDL Number:
MFCD00020292
IUPAC Name:
2,5-dimethylterephthalic acid
InChI:
InChI=1S/C10H10O4/c1-5-3-8(10(13)14)6(2)4-7(5)9(11)12/h3-4H,1-2H3,(H,11,12)(H,13,14)
InChI Key:
FKUJGZJNDUGCFU-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(C)c(cc1C)C(=O)O
NSC Number:
174018
Properties
Complexity:
223  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.058g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
194.186g/mol
Monoisotopic Mass:
194.058g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Literature
Title Journal
Poly[tris-(2,5-dimethyl-benzene-1,4--dicarboxyl-ato)bis-(pyridine)trizinc(II)]. Acta crystallographica. Section E, Structure reports online 20100301
Properties