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36830-02-1 | 2-Oxazolidinone, 5-[(1H-inden-7-yloxy)methyl]-3-(1-methylethyl)-
CAS No: 36830-02-1 Catalog No: AG0077WP MDL No:
Product Description
Catalog Number:
AG0077WP
Chemical Name:
2-Oxazolidinone, 5-[(1H-inden-7-yloxy)methyl]-3-(1-methylethyl)-
CAS Number:
36830-02-1
Molecular Formula:
C16H19NO3
Molecular Weight:
273.3270
IUPAC Name:
5-(3H-inden-4-yloxymethyl)-3-propan-2-yl-1,3-oxazolidin-2-one
InChI:
InChI=1S/C16H19NO3/c1-11(2)17-9-13(20-16(17)18)10-19-15-8-4-6-12-5-3-7-14(12)15/h3-6,8,11,13H,7,9-10H2,1-2H3
InChI Key:
ZJYAPHHNNSVXOG-UHFFFAOYSA-N
SMILES:
CC(N1CC(OC1=O)COc1cccc2c1CC=C2)C
Properties
Complexity:
393
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.136g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
273.332g/mol
Monoisotopic Mass:
273.136g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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