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Structure

3-(6-Methyl-2H-1 4-benzoxazin-3(4H)-one&

CAS
351003-19-5
Catalog Number
ACM351003195
Category
Other Products
Molecular Weight
216.239
Molecular Formula
C12H12N2O2

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Specification

Synonyms
3-(6-Methyl-2H-1,4-benzoxazin-3(4H)-one-4-yl)-propionitrile, 351003-19-5, ZINC04473183, AC1NDA5M, 548901_ALDRICH, CTK4H3616, AG-F-20751, MCULE-1134473125, 3-(6-methyl-3-oxo-1,4-benzoxazin-4-yl)propanenitrile, 4H-1,4-Benzoxazine-4-propanenitrile,2,3-dihydro-6-methyl-3-oxo-, 3-(6-METHYL-2H-1 4-BENZOXAZIN-3(4H)-ONE&;2,3-Dihydro-6-methyl-3-oxo-4H-1,4-benzoxazine-4-propionitrile
IUPAC Name
3-(6-methyl-3-oxo-1,4-benzoxazin-4-yl)propanenitrile
Canonical SMILES
CC1=CC2=C(C=C1)OCC(=O)N2CCC#N
InChI Key
SZEGFLHUNYLAOJ-UHFFFAOYSA-N
Boiling Point
515.2ºC at 760mmHg
Melting Point
128-132ºC(lit.)
Flash Point
265.4ºC
Density
1.21g/cm³
Exact Mass
216.09000
H-Bond Acceptor
3
H-Bond Donor
0
Packing Group
III
WGK Germany
3
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