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915921-41-4

915921-41-4 | 2-BENZYL-5-BROMO-1,3-BENZOXAZOLE

CAS No: 915921-41-4 Catalog No: AG006GL2 MDL No:MFCD08691467

Product Description

Catalog Number:
AG006GL2
Chemical Name:
2-BENZYL-5-BROMO-1,3-BENZOXAZOLE
CAS Number:
915921-41-4
Molecular Formula:
C14H10BrNO
Molecular Weight:
288.1393
MDL Number:
MFCD08691467
IUPAC Name:
2-benzyl-5-bromo-1,3-benzoxazole
InChI:
InChI=1S/C14H10BrNO/c15-11-6-7-13-12(9-11)16-14(17-13)8-10-4-2-1-3-5-10/h1-7,9H,8H2
InChI Key:
GIXLJAZFGSWIOI-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)nc(o2)Cc1ccccc1

Properties

Complexity:
255  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.995g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
288.144g/mol
Monoisotopic Mass:
286.995g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4  

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