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66502-74-7 | 1-IODOBUTANE-4,4,4-D3
CAS No: 66502-74-7 Catalog No: AG00FBPN MDL No:
Product Description
Catalog Number:
AG00FBPN
Chemical Name:
1-IODOBUTANE-4,4,4-D3
CAS Number:
66502-74-7
IUPAC Name:
1,1,1-trideuterio-4-iodobutane
InChI:
InChI=1S/C4H9I/c1-2-3-4-5/h2-4H2,1H3/i1D3
InChI Key:
KMGBZBJJOKUPIA-FIBGUPNXSA-N
Properties
Complexity:
13.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.994g/mol
Formal Charge:
0
Heavy Atom Count:
5
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
3
Molecular Weight:
187.039g/mol
Monoisotopic Mass:
186.994g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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