1H-Pyrazole, 1-(1-ethoxyethyl)-4-iodo-


Chemical Name: 1H-Pyrazole, 1-(1-ethoxyethyl)-4-iodo-
CAS Number: 575452-22-1
Product Number: AG00ECFV(AGN-PC-0LENND)
Synonyms:
MDL No: MFCD22123601
Molecular Formula: C7H11IN2O
Molecular Weight: 266.0795

Identification/Properties


Computed Properties
Molecular Weight:
266.082g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
3
Exact Mass:
265.992g/mol
Monoisotopic Mass:
265.992g/mol
Topological Polar Surface Area:
27A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
123
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:
H302-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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