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1202781-34-7 | 1-Ethyl-3-iodo-1H-pyrazole
CAS No: 1202781-34-7 Catalog No: AG0076QG MDL No:MFCD12756564
Product Description
Catalog Number:
AG0076QG
Chemical Name:
1-Ethyl-3-iodo-1H-pyrazole
CAS Number:
1202781-34-7
Molecular Formula:
C5H7IN2
Molecular Weight:
222.0269
MDL Number:
MFCD12756564
IUPAC Name:
1-ethyl-3-iodopyrazole
InChI:
InChI=1S/C5H7IN2/c1-2-8-4-3-5(6)7-8/h3-4H,2H2,1H3
InChI Key:
ZGIUXAGBPIWZKD-UHFFFAOYSA-N
SMILES:
CCn1ccc(n1)I
Properties
Complexity:
76.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.965g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.029g/mol
Monoisotopic Mass:
221.965g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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