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2060050-69-1

2060050-69-1 | 3-(iodomethyl)-2,7-dioxaspiro[4.5]decane

CAS No: 2060050-69-1 Catalog No: AG01BRDY MDL No:MFCD30502491

Product Description

Catalog Number:
AG01BRDY
Chemical Name:
3-(iodomethyl)-2,7-dioxaspiro[4.5]decane
CAS Number:
2060050-69-1
Molecular Formula:
C9H15IO2
Molecular Weight:
282.1187
MDL Number:
MFCD30502491
IUPAC Name:
3-(iodomethyl)-2,9-dioxaspiro[4.5]decane
InChI:
InChI=1S/C9H15IO2/c10-5-8-4-9(7-12-8)2-1-3-11-6-9/h8H,1-7H2
InChI Key:
XBTFGIAKJHERPD-UHFFFAOYSA-N
SMILES:
ICC1OCC2(C1)CCCOC2

Properties

Complexity:
163  
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:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

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