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1239363-40-6 | 1H-Pyrazole, 1-cyclopropyl-4-iodo-
CAS No: 1239363-40-6 Catalog No: AG000L8A MDL No:MFCD22573364
Product Description
Catalog Number:
AG000L8A
Chemical Name:
1H-Pyrazole, 1-cyclopropyl-4-iodo-
CAS Number:
1239363-40-6
Molecular Formula:
C6H7IN2
Molecular Weight:
234.0377
MDL Number:
MFCD22573364
IUPAC Name:
1-cyclopropyl-4-iodopyrazole
InChI:
InChI=1S/C6H7IN2/c7-5-3-8-9(4-5)6-1-2-6/h3-4,6H,1-2H2
InChI Key:
JBWOMLVMUQFTFQ-UHFFFAOYSA-N
SMILES:
Ic1cnn(c1)C1CC1
Properties
Complexity:
114
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.965g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
234.04g/mol
Monoisotopic Mass:
233.965g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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