6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylic acid


Chemical Name: 6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylic acid
CAS Number: 718621-99-9
Product Number: AG00FFBX(AGN-PC-03I1NV)
Synonyms:
MDL No:
Molecular Formula: C7H8N2O3
Molecular Weight: 168.1500

Identification/Properties


Computed Properties
Molecular Weight:
168.152g/mol
XLogP3:
0.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
168.053g/mol
Monoisotopic Mass:
168.053g/mol
Topological Polar Surface Area:
64.4A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
197
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302
Precautionary Statements:
P264-P270-P301+P312+P330-P501
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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