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87394-55-6 | 1-(3-Chloropyridin-2-yl)piperazine
CAS No: 87394-55-6 Catalog No: AG003CWN MDL No:MFCD08061034
Product Description
Catalog Number:
AG003CWN
Chemical Name:
1-(3-Chloropyridin-2-yl)piperazine
CAS Number:
87394-55-6
Molecular Formula:
C9H12ClN3
Molecular Weight:
197.6647
MDL Number:
MFCD08061034
IUPAC Name:
1-(3-chloropyridin-2-yl)piperazine
InChI:
InChI=1S/C9H12ClN3/c10-8-2-1-3-12-9(8)13-6-4-11-5-7-13/h1-3,11H,4-7H2
InChI Key:
HLCPXCHNWZGOMT-UHFFFAOYSA-N
SMILES:
Clc1cccnc1N1CCNCC1
Properties
Complexity:
159
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.072g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
197.666g/mol
Monoisotopic Mass:
197.072g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
28.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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