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Home Carboxys 1-tert-Butyl 3-methyl pyrazole-1,3-dicarboxylate

1-tert-Butyl 3-methyl pyrazole-1,3-dicarboxylate

CAS No.:
1820607-83-7
Catalog Number:
AG00I0HN
Molecular Formula:
C10H14N2O4
Molecular Weight:
226.2292
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$188
- +
5g
96%
In Stock USA
United States
$725
- +
Product Description
Catalog Number:
AG00I0HN
Chemical Name:
1-tert-Butyl 3-methyl pyrazole-1,3-dicarboxylate
CAS Number:
1820607-83-7
Molecular Formula:
C10H14N2O4
Molecular Weight:
226.2292
MDL Number:
MFCD26519873
IUPAC Name:
1-O-tert-butyl 3-O-methyl pyrazole-1,3-dicarboxylate
InChI:
InChI=1S/C10H14N2O4/c1-10(2,3)16-9(14)12-6-5-7(11-12)8(13)15-4/h5-6H,1-4H3
InChI Key:
BVQUOORGRDGCMX-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccn(n1)C(=O)OC(C)(C)C
Properties
Complexity:
285  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.095g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.232g/mol
Monoisotopic Mass:
226.095g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
70.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties