4-Iodo-1-tetrahydropyran-2-yl-pyrazole


Chemical Name: 4-Iodo-1-tetrahydropyran-2-yl-pyrazole
CAS Number: 938066-17-2
Product Number: AG00IHUZ(AGN-PC-0WALX2)
Synonyms:
MDL No:
Molecular Formula: C8H11IN2O
Molecular Weight: 278.0902

Identification/Properties


Computed Properties
Molecular Weight:
278.093g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
277.992g/mol
Monoisotopic Mass:
277.992g/mol
Topological Polar Surface Area:
27A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
156
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
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:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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