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152754-11-5 | Bis(4-isopropyl-4,5-dihydrooxazol-2-yl)methane
CAS No: 152754-11-5 Catalog No: AG003O9L MDL No:MFCD02020756
Product Description
Catalog Number:
AG003O9L
Chemical Name:
Bis(4-isopropyl-4,5-dihydrooxazol-2-yl)methane
CAS Number:
152754-11-5
Molecular Formula:
C13H22N2O2
Molecular Weight:
238.3260
MDL Number:
MFCD02020756
IUPAC Name:
4-propan-2-yl-2-[(4-propan-2-yl-4,5-dihydro-1,3-oxazol-2-yl)methyl]-4,5-dihydro-1,3-oxazole
InChI:
InChI=1S/C13H22N2O2/c1-8(2)10-6-16-12(14-10)5-13-15-11(7-17-13)9(3)4/h8-11H,5-7H2,1-4H3
InChI Key:
KEHOIBBPRFRZFW-UHFFFAOYSA-N
SMILES:
CC(C1COC(=N1)CC1=NC(CO1)C(C)C)C
Properties
Complexity:
302
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.168g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.331g/mol
Monoisotopic Mass:
238.168g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
43.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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