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113831-59-7 | 2-Octen-1-ol, 2,5,7,7-tetramethyl-
CAS No: 113831-59-7 Catalog No: AG0009UE MDL No:
Product Description
Catalog Number:
AG0009UE
Chemical Name:
2-Octen-1-ol, 2,5,7,7-tetramethyl-
CAS Number:
113831-59-7
Molecular Formula:
C12H24O
Molecular Weight:
184.3184
IUPAC Name:
2,5,7,7-tetramethyloct-2-en-1-ol
InChI:
InChI=1S/C12H24O/c1-10(8-12(3,4)5)6-7-11(2)9-13/h7,10,13H,6,8-9H2,1-5H3
InChI Key:
IUOJXPLFRLJQOW-UHFFFAOYSA-N
SMILES:
OCC(=CCC(CC(C)(C)C)C)C
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.183g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
184.323g/mol
Monoisotopic Mass:
184.183g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
4
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