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102771-95-9 | Oxazole, 4,5-dihydro-2-(3-methylbutyl)-
CAS No: 102771-95-9 Catalog No: AG0008CL MDL No:
Product Description
Catalog Number:
AG0008CL
Chemical Name:
Oxazole, 4,5-dihydro-2-(3-methylbutyl)-
CAS Number:
102771-95-9
Molecular Formula:
C8H15NO
Molecular Weight:
141.2108
IUPAC Name:
2-(3-methylbutyl)-4,5-dihydro-1,3-oxazole
InChI:
InChI=1S/C8H15NO/c1-7(2)3-4-8-9-5-6-10-8/h7H,3-6H2,1-2H3
InChI Key:
PSBVARSFGKKSIV-UHFFFAOYSA-N
SMILES:
CC(CCC1=NCCO1)C
Properties
Complexity:
129
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
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:
3
Topological Polar Surface Area:
21.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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