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137542-74-6 | Oxazole, 4-(1,1-dimethylethyl)-4,5-dihydro-2-methyl-, (4S)-
CAS No: 137542-74-6 Catalog No: AG0013J0 MDL No:MFCD00210030
Product Description
Catalog Number:
AG0013J0
Chemical Name:
Oxazole, 4-(1,1-dimethylethyl)-4,5-dihydro-2-methyl-, (4S)-
CAS Number:
137542-74-6
Molecular Formula:
C8H15NO
Molecular Weight:
141.2108
MDL Number:
MFCD00210030
IUPAC Name:
(4R)-4-tert-butyl-2-methyl-4,5-dihydro-1,3-oxazole
InChI:
InChI=1S/C8H15NO/c1-6-9-7(5-10-6)8(2,3)4/h7H,5H2,1-4H3/t7-/m0/s1
InChI Key:
HXVCLXDGKGJBRY-ZETCQYMHSA-N
SMILES:
CC1=N[C@H](CO1)C(C)(C)C
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
141.115g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
141.214g/mol
Monoisotopic Mass:
141.115g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
21.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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