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1017781-96-2

1017781-96-2 | Oxazolo[4,5-c]pyridine, 2-(4-bromophenyl)-4,5,6,7-tetrahydro-5-methyl-

CAS No: 1017781-96-2 Catalog No: AG0005IH MDL No:MFCD09997824

Product Description

Catalog Number:
AG0005IH
Chemical Name:
Oxazolo[4,5-c]pyridine, 2-(4-bromophenyl)-4,5,6,7-tetrahydro-5-methyl-
CAS Number:
1017781-96-2
Molecular Formula:
C13H13BrN2O
Molecular Weight:
293.1591
MDL Number:
MFCD09997824
IUPAC Name:
2-(4-bromophenyl)-5-methyl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine
InChI:
InChI=1S/C13H13BrN2O/c1-16-7-6-12-11(8-16)15-13(17-12)9-2-4-10(14)5-3-9/h2-5H,6-8H2,1H3
InChI Key:
RQEXRYVDXOZZIO-UHFFFAOYSA-N
SMILES:
CN1CCc2c(C1)nc(o2)c1ccc(cc1)Br

Properties

Complexity:
268  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.021g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
293.164g/mol
Monoisotopic Mass:
292.021g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
29.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  

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