Home Carboxys tert-Butyl 5-hydroxypyrazine-2-carboxylate

tert-Butyl 5-hydroxypyrazine-2-carboxylate

CAS No.:
1259478-79-9
Catalog Number:
AG00HIRC
Molecular Formula:
C9H12N2O3
Molecular Weight:
196.2032
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$527
- +
Product Description
Catalog Number:
AG00HIRC
Chemical Name:
tert-Butyl 5-hydroxypyrazine-2-carboxylate
CAS Number:
1259478-79-9
Molecular Formula:
C9H12N2O3
Molecular Weight:
196.2032
MDL Number:
MFCD18070855
IUPAC Name:
tert-butyl 6-oxo-1H-pyrazine-3-carboxylate
InChI:
InChI=1S/C9H12N2O3/c1-9(2,3)14-8(13)6-4-11-7(12)5-10-6/h4-5H,1-3H3,(H,11,12)
InChI Key:
QKLXHPLCQKZQCE-UHFFFAOYSA-N
SMILES:
O=C(c1ncc(=O)[nH]c1)OC(C)(C)C
Properties
Complexity:
323  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.085g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
196.206g/mol
Monoisotopic Mass:
196.085g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
67.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties