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1500924-89-9

1500924-89-9 | 7-Benzoxazolecarboxaldehyde, 2-methyl-

CAS No: 1500924-89-9 Catalog No: AG001MBM MDL No:

Product Description

Catalog Number:
AG001MBM
Chemical Name:
7-Benzoxazolecarboxaldehyde, 2-methyl-
CAS Number:
1500924-89-9
Molecular Formula:
C9H7NO2
Molecular Weight:
161.1574
IUPAC Name:
2-methyl-1,3-benzoxazole-7-carbaldehyde
InChI:
InChI=1S/C9H7NO2/c1-6-10-8-4-2-3-7(5-11)9(8)12-6/h2-5H,1H3
InChI Key:
FOBQOLLAQRZWBP-UHFFFAOYSA-N
SMILES:
O=Cc1cccc2c1oc(n2)C

Properties

Complexity:
183  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.048g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
161.16g/mol
Monoisotopic Mass:
161.048g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  

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