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849146-75-4 | 1-Hexanol, 6-[(3-ethyl-3-oxetanyl)methoxy]-
CAS No: 849146-75-4 Catalog No: AG004LY0 MDL No:
Product Description
Catalog Number:
AG004LY0
Chemical Name:
1-Hexanol, 6-[(3-ethyl-3-oxetanyl)methoxy]-
CAS Number:
849146-75-4
Molecular Formula:
C12H24O3
Molecular Weight:
216.3172
IUPAC Name:
6-[(3-ethyloxetan-3-yl)methoxy]hexan-1-ol
InChI:
InChI=1S/C12H24O3/c1-2-12(10-15-11-12)9-14-8-6-4-3-5-7-13/h13H,2-11H2,1H3
InChI Key:
WLSRZUMSWYUOQT-UHFFFAOYSA-N
SMILES:
OCCCCCCOCC1(CC)COC1
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.173g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
216.321g/mol
Monoisotopic Mass:
216.173g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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