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57101-63-0 | 4-ethyl-2-heptyl-2-oxazoline-4-methanol
CAS No: 57101-63-0 Catalog No: AG00EUM6 MDL No:
Product Description
Catalog Number:
AG00EUM6
Chemical Name:
4-ethyl-2-heptyl-2-oxazoline-4-methanol
CAS Number:
57101-63-0
IUPAC Name:
(4-ethyl-2-heptyl-5H-1,3-oxazol-4-yl)methanol
InChI:
InChI=1S/C13H25NO2/c1-3-5-6-7-8-9-12-14-13(4-2,10-15)11-16-12/h15H,3-11H2,1-2H3
InChI Key:
GGTHMQKJWFHHRT-UHFFFAOYSA-N
EC Number:
260-561-4
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.189g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
227.348g/mol
Monoisotopic Mass:
227.189g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
41.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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