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168297-86-7 | 2-Oxazolidinone, 5,5-dimethyl-4-(1-methylethyl)-, (4S)-
CAS No: 168297-86-7 Catalog No: AG001XZS MDL No:
Product Description
Catalog Number:
AG001XZS
Chemical Name:
2-Oxazolidinone, 5,5-dimethyl-4-(1-methylethyl)-, (4S)-
CAS Number:
168297-86-7
Molecular Formula:
C8H15NO2
Molecular Weight:
157.2102
IUPAC Name:
(4S)-5,5-dimethyl-4-propan-2-yl-1,3-oxazolidin-2-one
InChI:
InChI=1S/C8H15NO2/c1-5(2)6-8(3,4)11-7(10)9-6/h5-6H,1-4H3,(H,9,10)/t6-/m0/s1
InChI Key:
QICFUFOXXNIZFF-LURJTMIESA-N
SMILES:
CC([C@@H]1NC(=O)OC1(C)C)C
Properties
Complexity:
175
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
157.11g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
157.213g/mol
Monoisotopic Mass:
157.11g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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