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Acetoacetamide 97%

CAT: 0286-A03565-02Size: 100 gDry Ice: NoHazardous: No
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CAT#:0286-A03565-02Size:100 g
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CAS Number
5977-14-0
Pictogram
07 - Irritant
UDF Signal Word
Warning
MDL Number
MFCD00025528
Hazard Statement
H302 Harmful if swallowed; H312 Harmful in contact with skin; H315 Causes skin irritation; H319 Causes serious eye irritation; H332 Harmful if inhaled.
DOT Name
Not D.O.T.-Regulated
Precautions
P280 Wear protective gloves/protective clothing/eye protection/face protection; P301+P312 IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell; P302+P352 IF ON SKIN: wash with plenty of soap and water; P304+P340 IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing; P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing; P332+P313 IF SKIN irritation occurs: Get medical advice/attention.

Chemical Information

Acetoacetamide

Acetoacetamide is a monocarboxylic acid amide of acetoacetic acid. It is functionally related to an acetoacetic acid.

CAS Number5977-14-0
PubChem CID80077
IUPAC Name3-oxobutanamide
Molecular FormulaC4H7NO2
Molecular Weight101.10
XLogP-1
Topological Polar Surface Area60.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count7
Formal Charge0
Complexity97
SMILES
CC(=O)CC(=O)N
InChI
InChI=1S/C4H7NO2/c1-3(6)2-4(5)7/h2H2,1H3,(H2,5,7)
InChIKey
GCPWJFKTWGFEHH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Acetoacetamide
CAS: 5977-14-0
CID: 80077
Formula: C4H7NO2
MW: 101.10
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight101.10
XLogP3-1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass101.047678466
Monoisotopic Mass101.047678466
Topological Polar Surface Area60.2 Ų
Heavy Atom Count7
Formal Charge0
Complexity97.9
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
abx183832-01Acetoacetamide
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