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Home > Bromides > 1807164-92-6
1807164-92-6 | 4-Pyridinecarbonitrile, 2-bromo-6-methoxy-
CAS No: 1807164-92-6 Catalog No: AG00229Z MDL No:
Product Description
Catalog Number:
AG00229Z
Chemical Name:
4-Pyridinecarbonitrile, 2-bromo-6-methoxy-
CAS Number:
1807164-92-6
Molecular Formula:
C7H5BrN2O
Molecular Weight:
213.0314
IUPAC Name:
2-bromo-6-methoxypyridine-4-carbonitrile
InChI:
InChI=1S/C7H5BrN2O/c1-11-7-3-5(4-9)2-6(8)10-7/h2-3H,1H3
InChI Key:
OMNDLPYPERWPSQ-UHFFFAOYSA-N
SMILES:
COc1nc(Br)cc(c1)C#N
Properties
Complexity:
177
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.959g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
213.034g/mol
Monoisotopic Mass:
211.959g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
45.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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