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201221-74-1 | 2-Propenoic acid, 2-iodo-3-phenyl-, ethyl ester, (2Z)-
CAS No: 201221-74-1 Catalog No: AG002D9J MDL No:
Product Description
Catalog Number:
AG002D9J
Chemical Name:
2-Propenoic acid, 2-iodo-3-phenyl-, ethyl ester, (2Z)-
CAS Number:
201221-74-1
Molecular Formula:
C11H11IO2
Molecular Weight:
302.1083
IUPAC Name:
ethyl 2-iodo-3-phenylprop-2-enoate
InChI:
InChI=1S/C11H11IO2/c1-2-14-11(13)10(12)8-9-6-4-3-5-7-9/h3-8H,2H2,1H3
InChI Key:
NVVFDHZCRHFSEH-UHFFFAOYSA-N
SMILES:
CCOC(=O)/C(=C/c1ccccc1)/I
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.98g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
302.111g/mol
Monoisotopic Mass:
301.98g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.2
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