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2059975-69-6 | 3-(iodomethyl)-2,8-dioxaspiro[4.5]decane
CAS No: 2059975-69-6 Catalog No: AG01BRDR MDL No:MFCD30502484
Product Description
Catalog Number:
AG01BRDR
Chemical Name:
3-(iodomethyl)-2,8-dioxaspiro[4.5]decane
CAS Number:
2059975-69-6
Molecular Formula:
C9H15IO2
Molecular Weight:
282.1187
MDL Number:
MFCD30502484
IUPAC Name:
3-(iodomethyl)-2,8-dioxaspiro[4.5]decane
InChI:
InChI=1S/C9H15IO2/c10-6-8-5-9(7-12-8)1-3-11-4-2-9/h8H,1-7H2
InChI Key:
WZNBEHGZGXJKHT-UHFFFAOYSA-N
SMILES:
ICC1OCC2(C1)CCOCC2
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.012g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
282.121g/mol
Monoisotopic Mass:
282.012g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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