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88362-45-2 | Oxazole, 2-ethyl-4,5-dihydro-4-(1-methylethyl)-, (S)-
CAS No: 88362-45-2 Catalog No: AG004MV6 MDL No:
Product Description
Catalog Number:
AG004MV6
Chemical Name:
Oxazole, 2-ethyl-4,5-dihydro-4-(1-methylethyl)-, (S)-
CAS Number:
88362-45-2
Molecular Formula:
C8H15NO
Molecular Weight:
141.2108
IUPAC Name:
(4S)-2-ethyl-4-propan-2-yl-4,5-dihydro-1,3-oxazole
InChI:
InChI=1S/C8H15NO/c1-4-8-9-7(5-10-8)6(2)3/h6-7H,4-5H2,1-3H3/t7-/m1/s1
InChI Key:
GQLYBKSKZMMERS-SSDOTTSWSA-N
SMILES:
CCC1=N[C@H](CO1)C(C)C
Properties
Complexity:
140
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:
2
Topological Polar Surface Area:
21.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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