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138843-06-8 | 1,3-Benzodioxole, 5-(7-octen-1-yl)-
CAS No: 138843-06-8 Catalog No: AG0019OS MDL No:
Product Description
Catalog Number:
AG0019OS
Chemical Name:
1,3-Benzodioxole, 5-(7-octen-1-yl)-
CAS Number:
138843-06-8
Molecular Formula:
C15H20O2
Molecular Weight:
232.3181
IUPAC Name:
5-oct-7-enyl-1,3-benzodioxole
InChI:
InChI=1S/C15H20O2/c1-2-3-4-5-6-7-8-13-9-10-14-15(11-13)17-12-16-14/h2,9-11H,1,3-8,12H2
InChI Key:
LWTCBYZXQKFCGA-UHFFFAOYSA-N
SMILES:
C=CCCCCCCc1ccc2c(c1)OCO2
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.146g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
232.323g/mol
Monoisotopic Mass:
232.146g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.4
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