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Structure

L-Aspartic acid alpha-(7-amido-4-methylcoumarin)trifluoroacetic acid salt

CAS
336616-48-9
Catalog Number
ACM336616489
Category
Other Products
Molecular Weight
404.3
Molecular Formula
C14H14N2O5.C2HF3O2

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Specification

Synonyms
L-Aspartic acid a-(7-amido-4-methylcoumarin), trifluoroacetic acid salt
IUPAC Name
(3S)-3-azaniumyl-4-[(4-methyl-2-oxochromen-7-yl)amino]-4-oxobutanoate
Canonical SMILES
CC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)C(CC(=O)[O-])[NH₃+]
InChI Key
AAGPGZSFBVEQMU-JTQLQIEISA-N
Boiling Point
604.8ºC at 760 mmHg
Flash Point
319.6ºC
Density
1.452g/cm³
Exact Mass
290.09000
H-Bond Acceptor
5
H-Bond Donor
2
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