4-Acetamidobutyric acid

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Catalog Number
ACM3025965
Product Name
4-Acetamidobutyric acid
Structure
Structure
CAS
3025-96-5
Category
Heterocyclic Organic Compound
Synonyms
Acetyl-γ-aminobutyric acid
IUPAC Name
4-Acetamidobutanoic acid
Molecular Weight
145.16
Molecular Formula
C6H11NO3
Canonical SMILES
CC(=O)NCCCC(=O)O
InChI
InChI=1S/C6H11NO3/c1-5(8)7-4-2-3-6(9)10/h2-4H2,1H3,(H,7,8)(H,9,10)
InChI Key
UZTFMUBKZQVKLK-UHFFFAOYSA-N
Boiling Point
264.26 °C
Melting Point
128-131 °C
Flash Point
199 °C
Density
1.2511 g/cm³
Appearance
Solid
Storage
2-8 °C
Complexity
133
EC Number
221-186-1
Exact Mass
145.07389321
Hazard Statements
Xi:Irritant;
H-Bond Acceptor
3
H-Bond Donor
2
Monoisotopic Mass
145.07389321
pKa
4.65±0.10(Predicted)
Refractive Index
1.4772
Safety Description
S26-S37/39
Topological Polar Surface Area
66.4 Ų
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