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2138146-93-5 | 2-(oxan-4-yl)-1,3-oxazole
CAS No: 2138146-93-5 Catalog No: AG01EIL7 MDL No:MFCD31433272
Product Description
Catalog Number:
AG01EIL7
Chemical Name:
2-(oxan-4-yl)-1,3-oxazole
CAS Number:
2138146-93-5
Molecular Formula:
C8H11NO2
Molecular Weight:
153.1784
MDL Number:
MFCD31433272
IUPAC Name:
2-(oxan-4-yl)-1,3-oxazole
InChI:
InChI=1S/C8H11NO2/c1-4-10-5-2-7(1)8-9-3-6-11-8/h3,6-7H,1-2,4-5H2
InChI Key:
DMHXKOMRFHPXDX-UHFFFAOYSA-N
SMILES:
O1CCC(CC1)c1ncco1
Properties
Complexity:
123
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
153.079g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
153.181g/mol
Monoisotopic Mass:
153.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
35.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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