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Home Carboxys 3-(5-Methylthiophen-2-yl)-1H-pyrazole-5-carboxylic acid

3-(5-Methylthiophen-2-yl)-1H-pyrazole-5-carboxylic acid

CAS No.:
1025010-00-7
Catalog Number:
AG00J11F
Molecular Formula:
C9H8N2O2S
Molecular Weight:
208.2370
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$64
- +
5g
95%
In Stock USA
United States
$125
- +
10g
95%
In Stock USA
United States
$187
- +
Product Description
Catalog Number:
AG00J11F
Chemical Name:
3-(5-Methylthiophen-2-yl)-1H-pyrazole-5-carboxylic acid
CAS Number:
1025010-00-7
Molecular Formula:
C9H8N2O2S
Molecular Weight:
208.2370
MDL Number:
MFCD03030191
IUPAC Name:
5-(5-methylthiophen-2-yl)-1H-pyrazole-3-carboxylic acid
InChI:
InChI=1S/C9H8N2O2S/c1-5-2-3-8(14-5)6-4-7(9(12)13)11-10-6/h2-4H,1H3,(H,10,11)(H,12,13)
InChI Key:
JIJVBLCUMDFCFW-UHFFFAOYSA-N
SMILES:
Cc1ccc(s1)c1cc(n[nH]1)C(=O)O
Properties
Complexity:
237  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.031g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
208.235g/mol
Monoisotopic Mass:
208.031g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
94.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties