tert-butyl 1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxylate


Chemical Name: tert-butyl 1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxylate
CAS Number: 230301-11-8
Product Number: AG002LXI(AGN-PC-0N3SWP)
Synonyms:
MDL No: MFCD08059268
Molecular Formula: C11H17N3O2
Molecular Weight: 223.2716

Identification/Properties


Computed Properties
Molecular Weight:
223.276g/mol
XLogP3:
1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
223.132g/mol
Monoisotopic Mass:
223.132g/mol
Topological Polar Surface Area:
58.2A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
275
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#:
N/A
Hazard Statements:
H302-H315-H319-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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