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93841-68-0 | 2-(15-METHYLHEXADECYL)-2-OXAZOLINE-4,4-DIMETHANOL
CAS No: 93841-68-0 Catalog No: AG006CTN MDL No:
Product Description
Catalog Number:
AG006CTN
Chemical Name:
2-(15-METHYLHEXADECYL)-2-OXAZOLINE-4,4-DIMETHANOL
CAS Number:
93841-68-0
Molecular Formula:
C22H43NO3
Molecular Weight:
369.5817
IUPAC Name:
[4-(hydroxymethyl)-2-(15-methylhexadecyl)-5H-1,3-oxazol-4-yl]methanol
InChI:
InChI=1S/C22H43NO3/c1-20(2)15-13-11-9-7-5-3-4-6-8-10-12-14-16-21-23-22(17-24,18-25)19-26-21/h20,24-25H,3-19H2,1-2H3
InChI Key:
LLLDDDDBYVCSGR-UHFFFAOYSA-N
SMILES:
OCC1(CO)COC(=N1)CCCCCCCCCCCCCCC(C)C
EC Number:
299-039-6
Properties
Complexity:
364
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
369.324g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
369.59g/mol
Monoisotopic Mass:
369.324g/mol
Rotatable Bond Count:
17
Topological Polar Surface Area:
62A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.4
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