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Structure

2-ETHYLPHENYL ISOCYANATE

CAS
40411-25-4
Catalog Number
ACM40411254
Category
Other Products
Molecular Weight
147.17
Molecular Formula
C9H9NO

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Specification

Synonyms
2-Ethylphenyl isocyanate, o-Ethylphenyl isocyanate, 1-Ethyl-2-isocyanatobenzene, 251909_ALDRICH, ALBB-003029, CID583486, STK502549, ZINC00152302, AC31420, 40411-25-4
IUPAC Name
1-ethyl-2-isocyanatobenzene
Canonical SMILES
CCC1=CC=CC=C1N=C=O
InChI Key
ZVFNUQWYLXXSJM-UHFFFAOYSA-N
Boiling Point
211.4ºC at 760mmHg
Flash Point
73.1ºC
Density
1.043
Appearance
clear colorless liquid
Exact Mass
147.06800
Hazard Statements
Xn: Harmful;Xi: Irritant;
H-Bond Acceptor
2
H-Bond Donor
0
Packing Group
II
Safety Description
36/37/39-26-37/39-28-23

Downstream Synthesis Route 1

  • 301673-16-5
  • 40411-25-4
  • 1002339-37-8

Reference: [1]Patent: EP2039695,2009,A1 .Location in patent: Page/Page column 34

Downstream Synthesis Route 2

  • 88-58-4
  • 40411-25-4
  • 887704-24-7

Reference: [1]Russian Journal of Applied Chemistry,2008,vol. 81,p. 1821 - 1830

* For details of the synthesis route, please refer to the original source to ensure accuracy.

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