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163041-47-2 | 2-Propenoic acid, 2-iodo-3-methoxy-, methyl ester, (2Z)-
CAS No: 163041-47-2 Catalog No: AG001TN6 MDL No:
Product Description
Catalog Number:
AG001TN6
Chemical Name:
2-Propenoic acid, 2-iodo-3-methoxy-, methyl ester, (2Z)-
CAS Number:
163041-47-2
Molecular Formula:
C5H7IO3
Molecular Weight:
242.0118
IUPAC Name:
methyl (Z)-2-iodo-3-methoxyprop-2-enoate
InChI:
InChI=1S/C5H7IO3/c1-8-3-4(6)5(7)9-2/h3H,1-2H3/b4-3-
InChI Key:
MDXPNXGUQIAENO-ARJAWSKDSA-N
SMILES:
CO/C=C(/C(=O)OC)\I
Properties
Complexity:
130
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
241.944g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.012g/mol
Monoisotopic Mass:
241.944g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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