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10531-78-9

10531-78-9 | 5-Methylbenzo[d]oxazole

CAS No: 10531-78-9 Catalog No: AG003MVV MDL No:MFCD00216938

Product Description

Catalog Number:
AG003MVV
Chemical Name:
5-Methylbenzo[d]oxazole
CAS Number:
10531-78-9
Molecular Formula:
C8H7NO
Molecular Weight:
133.1473
MDL Number:
MFCD00216938
IUPAC Name:
5-methyl-1,3-benzoxazole
InChI:
InChI=1S/C8H7NO/c1-6-2-3-8-7(4-6)9-5-10-8/h2-5H,1H3
InChI Key:
UBIAVBGIRDRQLD-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)nco2

Properties

Complexity:
126  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
133.053g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
133.15g/mol
Monoisotopic Mass:
133.053g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  

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