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1638182-14-5 | 1-(tert-Butyl)-3-iodo-1H-pyrazole-4-carbonitrile
CAS No: 1638182-14-5 Catalog No: AG00AM1H MDL No:
Product Description
Catalog Number:
AG00AM1H
Chemical Name:
1-(tert-Butyl)-3-iodo-1H-pyrazole-4-carbonitrile
CAS Number:
1638182-14-5
IUPAC Name:
1-tert-butyl-3-iodopyrazole-4-carbonitrile
InChI:
InChI=1S/C8H10IN3/c1-8(2,3)12-5-6(4-10)7(9)11-12/h5H,1-3H3
InChI Key:
VGEWISTURRSKST-UHFFFAOYSA-N
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.992g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
275.093g/mol
Monoisotopic Mass:
274.992g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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