3,4-dichlorocinnamic acid

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Catalog Number
ACM1202397
Product Name
3,4-dichlorocinnamic acid
Structure
Structure
CAS
1202-39-7
Category
Heterocyclic Organic Compound
Synonyms
3-(3,4-Dichlorophenyl)-2-propenoicacid
IUPAC Name
(E)-3-(3,4-Dichlorophenyl)prop-2-enoic acid
Molecular Weight
217.05
Molecular Formula
C9H6Cl2O2
Canonical SMILES
C1=CC(=C(C=C1C=CC(=O)O)Cl)Cl
InChI
InChI=1S/C9H6Cl2O2/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5H,(H,12,13)/b4-2+
InChI Key
RRLUFPHCTSFKNR-DUXPYHPUSA-N
Boiling Point
366.6±32.0 °C
Melting Point
218-220 °C
Density
1.457±0.06 g/cm³
Exact Mass
215.9744848
Isomeric SMILES
C1=CC(=C(C=C1/C=C/C(=O)O)Cl)Cl
Monoisotopic Mass
215.9744848
Physical State
Crystalline powder
Storage Conditions
Dry place,Room Temperature
Topological Polar Surface Area
37.3 Ų
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