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2059970-83-9 | 4-tert-butyl-2-(iodomethyl)oxolane
CAS No: 2059970-83-9 Catalog No: AG01BRDM MDL No:MFCD30502479
Product Description
Catalog Number:
AG01BRDM
Chemical Name:
4-tert-butyl-2-(iodomethyl)oxolane
CAS Number:
2059970-83-9
Molecular Formula:
C9H17IO
Molecular Weight:
268.1352
MDL Number:
MFCD30502479
IUPAC Name:
4-tert-butyl-2-(iodomethyl)oxolane
InChI:
InChI=1S/C9H17IO/c1-9(2,3)7-4-8(5-10)11-6-7/h7-8H,4-6H2,1-3H3
InChI Key:
GVVJAZCSZQKDSG-UHFFFAOYSA-N
SMILES:
ICC1OCC(C1)C(C)(C)C
Properties
Complexity:
128
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.032g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
268.138g/mol
Monoisotopic Mass:
268.032g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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