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89482-46-2 | 1-Butanol, 4-[(1,3-dihydro-1,1,3,3-tetramethyl-2H-isoindol-2-yl)oxy]-
CAS No: 89482-46-2 Catalog No: AG0042DT MDL No:
Product Description
Catalog Number:
AG0042DT
Chemical Name:
1-Butanol, 4-[(1,3-dihydro-1,1,3,3-tetramethyl-2H-isoindol-2-yl)oxy]-
CAS Number:
89482-46-2
Molecular Formula:
C16H25NO2
Molecular Weight:
263.3752
IUPAC Name:
4-(1,1,3,3-tetramethylisoindol-2-yl)oxybutan-1-ol
InChI:
InChI=1S/C16H25NO2/c1-15(2)13-9-5-6-10-14(13)16(3,4)17(15)19-12-8-7-11-18/h5-6,9-10,18H,7-8,11-12H2,1-4H3
InChI Key:
YFOQYSHSMWFYMY-UHFFFAOYSA-N
SMILES:
OCCCCON1C(C)(C)c2c(C1(C)C)cccc2
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.189g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
263.381g/mol
Monoisotopic Mass:
263.189g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
32.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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