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66264-07-1 | 3-Oxazolidineethanol, 2-[4-(4-methyl-3-pentenyl)-3-cyclohexen-1-yl]-
CAS No: 66264-07-1 Catalog No: AG006OKC MDL No:
Product Description
Catalog Number:
AG006OKC
Chemical Name:
3-Oxazolidineethanol, 2-[4-(4-methyl-3-pentenyl)-3-cyclohexen-1-yl]-
CAS Number:
66264-07-1
Molecular Formula:
C17H29NO2
Molecular Weight:
279.4177
IUPAC Name:
2-[2-[4-(4-methylpent-3-enyl)cyclohex-3-en-1-yl]-1,3-oxazolidin-3-yl]ethanol
InChI:
InChI=1S/C17H29NO2/c1-14(2)4-3-5-15-6-8-16(9-7-15)17-18(10-12-19)11-13-20-17/h4,6,16-17,19H,3,5,7-13H2,1-2H3
InChI Key:
SPKXTNNCTNFVJO-UHFFFAOYSA-N
SMILES:
OCCN1CCOC1C1CCC(=CC1)CCC=C(C)C
Properties
Complexity:
358
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.22g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
279.424g/mol
Monoisotopic Mass:
279.22g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
32.7A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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