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1147893-28-4 | Pyridine, 5-(2-bromoethyl)-2-methyl-
CAS No: 1147893-28-4 Catalog No: AG000F79 MDL No:
Product Description
Catalog Number:
AG000F79
Chemical Name:
Pyridine, 5-(2-bromoethyl)-2-methyl-
CAS Number:
1147893-28-4
Molecular Formula:
C8H10BrN
Molecular Weight:
200.0757
IUPAC Name:
5-(2-bromoethyl)-2-methylpyridine
InChI:
InChI=1S/C8H10BrN/c1-7-2-3-8(4-5-9)6-10-7/h2-3,6H,4-5H2,1H3
InChI Key:
CQDJTHLAWUGLOV-UHFFFAOYSA-N
SMILES:
BrCCc1ccc(nc1)C
Properties
Complexity:
95.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
200.079g/mol
Monoisotopic Mass:
199g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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