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10168-00-0 | Pyridine, 4-bromo-3-methyl-
CAS No: 10168-00-0 Catalog No: AG000579 MDL No:MFCD01646140
Product Description
Catalog Number:
AG000579
Chemical Name:
Pyridine, 4-bromo-3-methyl-
CAS Number:
10168-00-0
Molecular Formula:
C6H6BrN
Molecular Weight:
172.0225
MDL Number:
MFCD01646140
IUPAC Name:
4-bromo-3-methylpyridine
InChI:
InChI=1S/C6H6BrN/c1-5-4-8-3-2-6(5)7/h2-4H,1H3
InChI Key:
GYUAOSJIGMDMNJ-UHFFFAOYSA-N
SMILES:
Cc1cnccc1Br
Properties
Complexity:
74.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.968g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
172.025g/mol
Monoisotopic Mass:
170.968g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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