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1227585-42-3

1227585-42-3 | Pyridine, 2-(bromomethyl)-5-chloro-3-(trifluoromethyl)-

CAS No: 1227585-42-3 Catalog No: AG000JCK MDL No:

Product Description

Catalog Number:
AG000JCK
Chemical Name:
Pyridine, 2-(bromomethyl)-5-chloro-3-(trifluoromethyl)-
CAS Number:
1227585-42-3
Molecular Formula:
C7H4BrClF3N
Molecular Weight:
274.4656
IUPAC Name:
2-(bromomethyl)-5-chloro-3-(trifluoromethyl)pyridine
InChI:
InChI=1S/C7H4BrClF3N/c8-2-6-5(7(10,11)12)1-4(9)3-13-6/h1,3H,2H2
InChI Key:
HEGQUHJLUFJGJA-UHFFFAOYSA-N
SMILES:
BrCc1ncc(cc1C(F)(F)F)Cl

Properties

Complexity:
176  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.917g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
274.465g/mol
Monoisotopic Mass:
272.917g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  

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