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85793-96-0 | 7-Octen-2-ol, 8-(diethylamino)-2,6-dimethyl-, (E)-
CAS No: 85793-96-0 Catalog No: AG004XXF MDL No:
Product Description
Catalog Number:
AG004XXF
Chemical Name:
7-Octen-2-ol, 8-(diethylamino)-2,6-dimethyl-, (E)-
CAS Number:
85793-96-0
Molecular Formula:
C14H29NO
Molecular Weight:
227.3862
IUPAC Name:
8-(diethylamino)-2,6-dimethyloct-7-en-2-ol
InChI:
InChI=1S/C14H29NO/c1-6-15(7-2)12-10-13(3)9-8-11-14(4,5)16/h10,12-13,16H,6-9,11H2,1-5H3
InChI Key:
KLHHMUKZEGADLG-UHFFFAOYSA-N
SMILES:
CCN(/C=C/C(CCCC(O)(C)C)C)CC
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.225g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
227.392g/mol
Monoisotopic Mass:
227.225g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
23.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
3.4
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