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89779-46-4 | 2H-Pyran, tetrahydro-2-[[2-(iodomethylene)-4-pentenyl]oxy]-
CAS No: 89779-46-4 Catalog No: AG003YNY MDL No:
Product Description
Catalog Number:
AG003YNY
Chemical Name:
2H-Pyran, tetrahydro-2-[[2-(iodomethylene)-4-pentenyl]oxy]-
CAS Number:
89779-46-4
Molecular Formula:
C11H17IO2
Molecular Weight:
308.1559
IUPAC Name:
2-[2-(iodomethylidene)pent-4-enoxy]oxane
InChI:
InChI=1S/C11H17IO2/c1-2-5-10(8-12)9-14-11-6-3-4-7-13-11/h2,8,11H,1,3-7,9H2
InChI Key:
HXZGIGDMWLKOKH-UHFFFAOYSA-N
SMILES:
C=CCC(=CI)COC1CCCCO1
Properties
Complexity:
202
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
308.027g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
308.159g/mol
Monoisotopic Mass:
308.027g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
3.4
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