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Home Carboxys tert-Butyl 4-hydroxy-3-methyl-1h-pyrazole-1-carboxylate

tert-Butyl 4-hydroxy-3-methyl-1h-pyrazole-1-carboxylate

CAS No.:
1394947-71-7
Catalog Number:
AG00HVM1
Molecular Formula:
C9H14N2O3
Molecular Weight:
198.2191
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$438
- +
5g
96%
In Stock USA
United States
$1500
- +
Product Description
Catalog Number:
AG00HVM1
Chemical Name:
tert-Butyl 4-hydroxy-3-methyl-1h-pyrazole-1-carboxylate
CAS Number:
1394947-71-7
Molecular Formula:
C9H14N2O3
Molecular Weight:
198.2191
MDL Number:
MFCD23110939
IUPAC Name:
tert-butyl 4-hydroxy-3-methylpyrazole-1-carboxylate
InChI:
InChI=1S/C9H14N2O3/c1-6-7(12)5-11(10-6)8(13)14-9(2,3)4/h5,12H,1-4H3
InChI Key:
YEESJLLYIOGDSB-UHFFFAOYSA-N
SMILES:
Oc1cn(nc1C)C(=O)OC(C)(C)C
Properties
Complexity:
225  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.1g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
198.222g/mol
Monoisotopic Mass:
198.1g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties