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Structure

N-(2-Furoyl)glycine

CAS
5657-19-2
Catalog Number
ACM5657192
Category
Other Products
Molecular Weight
169.13
Molecular Formula
C7H7NO4

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Specification

Synonyms
Pyromucuric acid
IUPAC Name
2-(Furan-2-carbonylamino)acetic acid
Canonical SMILES
C1=COC(=C1)C(=O)NCC(=O)O
InChI
InChI=1S/C7H7NO4/c9-6(10)4-8-7(11)5-2-1-3-12-5/h1-3H,4H2,(H,8,11)(H,9,10)
InChI Key
KSPQDMRTZZYQLM-UHFFFAOYSA-N
Boiling Point
466.0±25.0 °C
Melting Point
163-165 °C(lit.)
Flash Point
220.3 °C
Density
1.367±0.06 g/cm³
Appearance
White to off-white solid
Storage
Hygroscopic, -20 °C freezer, under inert atmosphere
Complexity
192
Exact Mass
169.03750770
Hazard Statements
Xi
H-Bond Acceptor
3
H-Bond Donor
1
Monoisotopic Mass
169.03750770
pKa
3.66±0.10(Predicted)
Safety Description
26-36
Topological Polar Surface Area
79.5 Ų
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