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1353983-68-2

1353983-68-2 | N-(6-Bromo-pyridin-3-ylmethyl)-2-chloro-acetamide

CAS No: 1353983-68-2 Catalog No: AG01F9A1 MDL No:

Product Description

Catalog Number:
AG01F9A1
Chemical Name:
N-(6-Bromo-pyridin-3-ylmethyl)-2-chloro-acetamide
CAS Number:
1353983-68-2
Molecular Formula:
C8H8BrClN2O
Molecular Weight:
263.5189
IUPAC Name:
N-[(6-bromopyridin-3-yl)methyl]-2-chloroacetamide
InChI:
InChI=1S/C8H8BrClN2O/c9-7-2-1-6(4-11-7)5-12-8(13)3-10/h1-2,4H,3,5H2,(H,12,13)
InChI Key:
BRENVDLMEJNWIB-UHFFFAOYSA-N
SMILES:
ClCC(=O)NCc1ccc(nc1)Br

Properties

Complexity:
180  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.951g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
263.519g/mol
Monoisotopic Mass:
261.951g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  

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