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1187386-00-0 | 3-((4-Iodo-1H-pyrazol-1-yl);methyl);pyridine
CAS No: 1187386-00-0 Catalog No: AG003HYY MDL No:MFCD12756453
Product Description
Catalog Number:
AG003HYY
Chemical Name:
3-((4-Iodo-1H-pyrazol-1-yl);methyl);pyridine
CAS Number:
1187386-00-0
Molecular Formula:
C9H8IN3
Molecular Weight:
285.0844
MDL Number:
MFCD12756453
IUPAC Name:
3-[(4-iodopyrazol-1-yl)methyl]pyridine
InChI:
InChI=1S/C9H8IN3/c10-9-5-12-13(7-9)6-8-2-1-3-11-4-8/h1-5,7H,6H2
InChI Key:
CYDDDZSHUDUZPN-UHFFFAOYSA-N
SMILES:
Ic1cnn(c1)Cc1cccnc1
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.976g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
285.088g/mol
Monoisotopic Mass:
284.976g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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