Home Other Building Blocks 1-METHYL-3-THIEN-2-YL-1H-PYRAZOLE-5-CARBOXYLIC ACID

1-METHYL-3-THIEN-2-YL-1H-PYRAZOLE-5-CARBOXYLIC ACID

CAS No.:
871825-56-8
Catalog Number:
AG004NL6
Molecular Formula:
C9H8N2O2S
Molecular Weight:
208.2370
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
1 week
United States
$135
- +
1g
1 week
United States
$225
- +
Product Description
Catalog Number:
AG004NL6
Chemical Name:
1-METHYL-3-THIEN-2-YL-1H-PYRAZOLE-5-CARBOXYLIC ACID
CAS Number:
871825-56-8
Molecular Formula:
C9H8N2O2S
Molecular Weight:
208.2370
MDL Number:
MFCD08271954
IUPAC Name:
2-methyl-5-thiophen-2-ylpyrazole-3-carboxylic acid
InChI:
InChI=1S/C9H8N2O2S/c1-11-7(9(12)13)5-6(10-11)8-3-2-4-14-8/h2-5H,1H3,(H,12,13)
InChI Key:
YSTOGMCNCZGBTG-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(nn1C)c1cccs1
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:
1  
Isotope Atom Count:
0
Molecular Weight:
208.235g/mol
Monoisotopic Mass:
208.031g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
83.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties