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142940-52-1 | Pyrrolo[2,1-b]oxazol-5(6H)-one, 7a-ethyltetrahydro-
CAS No: 142940-52-1 Catalog No: AG006X4U MDL No:
Product Description
Catalog Number:
AG006X4U
Chemical Name:
Pyrrolo[2,1-b]oxazol-5(6H)-one, 7a-ethyltetrahydro-
CAS Number:
142940-52-1
Molecular Formula:
C8H13NO2
Molecular Weight:
155.1943
IUPAC Name:
7a-ethyl-2,3,6,7-tetrahydropyrrolo[2,1-b][1,3]oxazol-5-one
InChI:
InChI=1S/C8H13NO2/c1-2-8-4-3-7(10)9(8)5-6-11-8/h2-6H2,1H3
InChI Key:
BNBAZUKYDMBURZ-UHFFFAOYSA-N
SMILES:
CCC12OCCN2C(=O)CC1
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.095g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
155.197g/mol
Monoisotopic Mass:
155.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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