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Home Carboxys 5-(Thiophen-2-yl)-1H-pyrazole-4-carboxylic acid

5-(Thiophen-2-yl)-1H-pyrazole-4-carboxylic acid

CAS No.:
879996-80-2
Catalog Number:
AG00H40G
Molecular Formula:
C8H6N2O2S
Molecular Weight:
194.2104
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$168
- +
5g
95%
In Stock USA
United States
$444
- +
Product Description
Catalog Number:
AG00H40G
Chemical Name:
5-(Thiophen-2-yl)-1H-pyrazole-4-carboxylic acid
CAS Number:
879996-80-2
Molecular Formula:
C8H6N2O2S
Molecular Weight:
194.2104
MDL Number:
MFCD06203210
IUPAC Name:
5-thiophen-2-yl-1H-pyrazole-4-carboxylic acid
InChI:
InChI=1S/C8H6N2O2S/c11-8(12)5-4-9-10-7(5)6-2-1-3-13-6/h1-4H,(H,9,10)(H,11,12)
InChI Key:
MICDYEVWWIBWRC-UHFFFAOYSA-N
SMILES:
OC(=O)c1c[nH]nc1c1cccs1
Properties
Complexity:
212  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.015g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
194.208g/mol
Monoisotopic Mass:
194.015g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
94.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties