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Structure

Acetic acid,2-isocyanato-,butyl ester

CAS
17046-22-9
Catalog Number
ACM17046229
Category
Other Products
Molecular Weight
157.17
Molecular Formula
C7H11NO3

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Specification

Synonyms
Butyl isocyanatoacetate, n-Butyl isocyanatoacetate, 482889_ALDRICH, butyl N-(oxomethylene)glycinate, butyl N-(oxomethylidene)glycinate, STK504631, Acetic acid, isocyanato-, butyl ester, ALBB-007571, CID86921, EINECS 241-114-2, NSC518681, ZINC01604664, NSC 518681, Acetic acid, 2-isocyanato-, butyl ester, 17046-22-9
IUPAC Name
butyl 2-isocyanatoacetate
Canonical SMILES
CCCCOC(=O)CN=C=O
InChI Key
RMZSOGJUEUFCBK-UHFFFAOYSA-N
Boiling Point
194.9ºC at 760mmHg
Flash Point
70.7ºC
Density
1.04g/cm³
Appearance
Clear colorless to slightly yellow liquid
EC Number
241-114-2
Exact Mass
157.07400
Hazard Statements
Xn: Harmful;
H-Bond Acceptor
4
H-Bond Donor
0
Safety Description
23-26-36
WGK Germany
3
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