Home Carboxys tert-Butyl 3-phenylpyrazole-1-carboxylate

tert-Butyl 3-phenylpyrazole-1-carboxylate

CAS No.:
1820711-47-4
Catalog Number:
AG00I104
Molecular Formula:
C14H16N2O2
Molecular Weight:
244.2890
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
96%
In Stock USA
United States
$225
- +
1g
96%
In Stock USA
United States
$563
- +
Product Description
Catalog Number:
AG00I104
Chemical Name:
tert-Butyl 3-phenylpyrazole-1-carboxylate
CAS Number:
1820711-47-4
Molecular Formula:
C14H16N2O2
Molecular Weight:
244.2890
MDL Number:
MFCD28122677
IUPAC Name:
tert-butyl 3-phenylpyrazole-1-carboxylate
InChI:
InChI=1S/C14H16N2O2/c1-14(2,3)18-13(17)16-10-9-12(15-16)11-7-5-4-6-8-11/h4-10H,1-3H3
InChI Key:
GDEQKBQAXPSVOR-UHFFFAOYSA-N
SMILES:
O=C(n1ccc(n1)c1ccccc1)OC(C)(C)C
Properties
Complexity:
293  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.121g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
244.294g/mol
Monoisotopic Mass:
244.121g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties