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645413-12-3 | 2H-Pyran, tetrahydro-5-iodo-2-methoxy-
CAS No: 645413-12-3 Catalog No: AG00H60W MDL No:
Product Description
Catalog Number:
AG00H60W
Chemical Name:
2H-Pyran, tetrahydro-5-iodo-2-methoxy-
CAS Number:
645413-12-3
Molecular Formula:
C6H11IO2
Molecular Weight:
242.0548
IUPAC Name:
5-iodo-2-methoxyoxane
InChI:
InChI=1S/C6H11IO2/c1-8-6-3-2-5(7)4-9-6/h5-6H,2-4H2,1H3
InChI Key:
UPGBGMFCKPAOKF-UHFFFAOYSA-N
SMILES:
COC1CCC(CO1)I
Properties
Complexity:
87.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.98g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.056g/mol
Monoisotopic Mass:
241.98g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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