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1227493-85-7 | 2-Pyridinamine, 5-bromo-3-(chloromethyl)-
CAS No: 1227493-85-7 Catalog No: AG000JA4 MDL No:
Product Description
Catalog Number:
AG000JA4
Chemical Name:
2-Pyridinamine, 5-bromo-3-(chloromethyl)-
CAS Number:
1227493-85-7
Molecular Formula:
C6H6BrClN2
Molecular Weight:
221.4822
IUPAC Name:
5-bromo-3-(chloromethyl)pyridin-2-amine
InChI:
InChI=1S/C6H6BrClN2/c7-5-1-4(2-8)6(9)10-3-5/h1,3H,2H2,(H2,9,10)
InChI Key:
FNIFEOGSSIXAHS-UHFFFAOYSA-N
SMILES:
ClCc1cc(Br)cnc1N
Properties
Complexity:
112
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.94g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
221.482g/mol
Monoisotopic Mass:
219.94g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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