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32999-01-2

32999-01-2 | 5-(1-METHYLETHYL)-OXAZOLE

CAS No: 32999-01-2 Catalog No: AG01E73U MDL No:MFCD26516235

Product Description

Catalog Number:
AG01E73U
Chemical Name:
5-(1-METHYLETHYL)-OXAZOLE
CAS Number:
32999-01-2
Molecular Formula:
C6H9NO
Molecular Weight:
111.1418
MDL Number:
MFCD26516235
IUPAC Name:
5-propan-2-yl-1,3-oxazole
InChI:
InChI=1S/C6H9NO/c1-5(2)6-3-7-4-8-6/h3-5H,1-2H3
InChI Key:
FGBZKVZPZYYCLH-UHFFFAOYSA-N
SMILES:
CC(c1ocnc1)C

Properties

Complexity:
72.9  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
111.068g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
111.144g/mol
Monoisotopic Mass:
111.068g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  

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