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30315-47-0 | 5-Oxazolidinemethanol, 3-(1,1-dimethylethyl)-, (S)- (9CI)
CAS No: 30315-47-0 Catalog No: AG002ZON MDL No:
Product Description
Catalog Number:
AG002ZON
Chemical Name:
5-Oxazolidinemethanol, 3-(1,1-dimethylethyl)-, (S)- (9CI)
CAS Number:
30315-47-0
Molecular Formula:
C8H17NO2
Molecular Weight:
159.2261
IUPAC Name:
[(5S)-3-tert-butyl-1,3-oxazolidin-5-yl]methanol
InChI:
InChI=1S/C8H17NO2/c1-8(2,3)9-4-7(5-10)11-6-9/h7,10H,4-6H2,1-3H3/t7-/m0/s1
InChI Key:
UOAOHHKCFZRLLL-ZETCQYMHSA-N
SMILES:
OC[C@H]1OCN(C1)C(C)(C)C
EC Number:
250-126-7
Properties
Complexity:
131
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
159.126g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
159.229g/mol
Monoisotopic Mass:
159.126g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
32.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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