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Structure

2-sec-Butylphenyl isocyanate,97%

CAS
480439-17-6
Catalog Number
ACM480439176
Category
Other Products
Molecular Weight
175.23
Molecular Formula
C11H13NO

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Specification

Synonyms
2-sec-Butylphenyl isocyanate, 480439-17-6, ACMC-20anmw, AC1NPHOR, 568902_ALDRICH, CTK8C6015, 1-butan-2-yl-2-isocyanatobenzene, KB-176069
IUPAC Name
1-butan-2-yl-2-isocyanatobenzene
Canonical SMILES
CCC(C)C1=CC=CC=C1N=C=O
InChI Key
WJDNRCCJBHKDTR-UHFFFAOYSA-N
Boiling Point
219-220ºC(lit.)
Flash Point
195 °F
Density
0.999 g/mL at 25ºC(lit.)
Exact Mass
175.10000
Hazard Statements
Xn
H-Bond Acceptor
2
H-Bond Donor
0
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