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6305-40-4 | 1,3-DIIODOACETONE
CAS No: 6305-40-4 Catalog No: AG00EF4M MDL No:MFCD01696572
Product Description
Catalog Number:
AG00EF4M
Chemical Name:
1,3-DIIODOACETONE
CAS Number:
6305-40-4
Molecular Formula:
C3H4I2O
Molecular Weight:
309.8722
MDL Number:
MFCD01696572
IUPAC Name:
1,3-diiodopropan-2-one
InChI:
InChI=1S/C3H4I2O/c4-1-3(6)2-5/h1-2H2
InChI Key:
OKARNAREDZHGLR-UHFFFAOYSA-N
SMILES:
ICC(=O)CI
NSC Number:
41123
Properties
Complexity:
46.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
309.835g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
309.873g/mol
Monoisotopic Mass:
309.835g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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