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64186-22-7 | (E)-3-(5-IODO-2-FURYL)PROP-2-ENOIC ACID
CAS No: 64186-22-7 Catalog No: AG00EB8W MDL No:MFCD02180669
Product Description
Catalog Number:
AG00EB8W
Chemical Name:
(E)-3-(5-IODO-2-FURYL)PROP-2-ENOIC ACID
CAS Number:
64186-22-7
Molecular Formula:
C7H5IO3
Molecular Weight:
264.0173
MDL Number:
MFCD02180669
IUPAC Name:
(E)-3-(5-iodofuran-2-yl)prop-2-enoic acid
InChI:
InChI=1S/C7H5IO3/c8-6-3-1-5(11-6)2-4-7(9)10/h1-4H,(H,9,10)/b4-2+
InChI Key:
QPFNTMHXPHLWHM-DUXPYHPUSA-N
SMILES:
OC(=O)/C=C/c1ccc(o1)I
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
263.928g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
264.018g/mol
Monoisotopic Mass:
263.928g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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