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1449117-51-4

1449117-51-4 | Pyridine, 2-[4-(chloromethyl)-1H-pyrazol-1-yl]-, hydrochloride (1:1)

CAS No: 1449117-51-4 Catalog No: AG001KCR MDL No:MFCD23704680

Product Description

Catalog Number:
AG001KCR
Chemical Name:
Pyridine, 2-[4-(chloromethyl)-1H-pyrazol-1-yl]-, hydrochloride (1:1)
CAS Number:
1449117-51-4
Molecular Formula:
C9H9Cl2N3
Molecular Weight:
230.0939
MDL Number:
MFCD23704680
IUPAC Name:
2-[4-(chloromethyl)pyrazol-1-yl]pyridine;hydrochloride
InChI:
InChI=1S/C9H8ClN3.ClH/c10-5-8-6-12-13(7-8)9-3-1-2-4-11-9;/h1-4,6-7H,5H2;1H
InChI Key:
BJAOCKJFORRXTM-UHFFFAOYSA-N
SMILES:
ClCc1cnn(c1)c1ccccn1.Cl

Properties

Complexity:
165  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.017g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
230.092g/mol
Monoisotopic Mass:
229.017g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
30.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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