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1865088-79-4 | 4-(3,3-dimethylbutan-2-yl)-1,3-oxazolidin-2-one
CAS No: 1865088-79-4 Catalog No: AG01C6YY MDL No:MFCD31433231
Product Description
Catalog Number:
AG01C6YY
Chemical Name:
4-(3,3-dimethylbutan-2-yl)-1,3-oxazolidin-2-one
CAS Number:
1865088-79-4
Molecular Formula:
C9H17NO2
Molecular Weight:
171.2368
MDL Number:
MFCD31433231
IUPAC Name:
4-(3,3-dimethylbutan-2-yl)-1,3-oxazolidin-2-one
InChI:
InChI=1S/C9H17NO2/c1-6(9(2,3)4)7-5-12-8(11)10-7/h6-7H,5H2,1-4H3,(H,10,11)
InChI Key:
MFZVKUSECNMLRP-UHFFFAOYSA-N
SMILES:
CC(C(C)(C)C)C1COC(=O)N1
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.126g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
171.24g/mol
Monoisotopic Mass:
171.126g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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