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867165-53-5 | (3-chloropyrazin-2-yl)methanamine dihydrochloride
CAS No: 867165-53-5 Catalog No: AG0036C2 MDL No:MFCD07644629
Product Description
Catalog Number:
AG0036C2
Chemical Name:
(3-chloropyrazin-2-yl)methanamine dihydrochloride
CAS Number:
867165-53-5
Molecular Formula:
C5H8Cl3N3
Molecular Weight:
216.4961
MDL Number:
MFCD07644629
IUPAC Name:
(3-chloropyrazin-2-yl)methanamine;dihydrochloride
InChI:
InChI=1S/C5H6ClN3.2ClH/c6-5-4(3-7)8-1-2-9-5;;/h1-2H,3,7H2;2*1H
InChI Key:
RHKWGVWUXBFIIE-UHFFFAOYSA-N
SMILES:
NCc1nccnc1Cl.Cl.Cl
Properties
Complexity:
88.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.978g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
216.49g/mol
Monoisotopic Mass:
214.978g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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