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CAS Number: 33994-44-4
methyl 3-(4-iodophenyl)propanoate

Structure

methyl 3-(4-iodophenyl)propanoate
Name: methyl 3-(4-iodophenyl)propanoate
Synonyms:
General Information
Product Number: 33994444

CAS Registry Number 33994-44-4
Name:
Benzenepropanoic acid, 4-​iodo-​, methyl ester
Hydrocinnamic acid, p-iodo-, methyl ester (8CI)
Methyl 3-(4-iodophenyl)propanoate
Methyl 3-(4-iodophenyl)propionate
Methyl 4-iodophenylpropionate

 

Chemical Formula: C10H11IO2
Exact Mass: 289.98
Molecular Weight: 290.10
m/z: 289.98 (100.0%), 290.98 (10.9%)

 

InChI:InChI=1S/C10H11IO2/c1-13-10(12)7-4-8-2-5-9(11)6-3-8/h2-3,5-6H,4,7H2,1H3

InChI Key:LDCXVBUZHUHPAJ-UHFFFAOYSA-N

Canonical SMILES:COC(=O)CCC1=CC=C(C=C1)I

 

Thermal Properties Value Condition Note
Melting Point 46 °C   (1)CAS

Specification

98%

References
  1. (1) Rosen, Brad M.; Organic Letters 2008, V10(12), P2597-2600 CAPLUS
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