Benzoicacid,3-isocyanato-,ethyl ester

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Catalog Number
ACM67531684
Product Name
Benzoicacid,3-isocyanato-,ethyl ester
Structure
Structure
CAS
67531-68-4
Category
Heterocyclic Organic Compound
Synonyms
Ethyl 3-isocyanatobenzoate, 3-Carboethoxyphenyl isocyanate, 3-Carbethoxyphenyl isocyanate, 440000_ALDRICH, 3-Ethoxycarbonylphenyl isocyanate, STK504585, ALBB-007515, CID589806, ZINC02560440, 67531-68-4
IUPAC Name
ethyl 3-isocyanatobenzoate
Molecular Weight
191.19
Molecular Formula
C10H9NO3
Canonical SMILES
CCOC(=O)C1=CC(=CC=C1)N=C=O
InChI Key
UPXGGIRFDZENRD-UHFFFAOYSA-N
Boiling Point
213ºC(lit.)
Flash Point
>230 °F
Density
1.154
Exact Mass
191.05800
Hazard Statements
Xn
H-Bond Acceptor
4
H-Bond Donor
0
Packing Group
III
Safety Description
S23-S26-S36/37/39-S45
WGK Germany
3
MSDS
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COA
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Spec Sheet
Download Spec Sheet
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