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N N-Diethylacetamide 99% - Carc.

CAT: 0286-D19520-01Size: 25 gDry Ice: NoHazardous: No
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CAT#:0286-D19520-01Size:25 g
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CAS Number
685-91-6
Pictogram
07 - Irritant
UDF Signal Word
Warning
MDL Number
MFCD00009047
Hazard Statement
H302 Harmful if swallowed; H312 Harmful in contact with skin; H315 Causes skin irritation; H320 Causes 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

N,N-Diethylacetamide
CAS Number685-91-6
PubChem CID12703
IUPAC NameN,N-diethylacetamide
Molecular FormulaC6H13NO
Molecular Weight115.17
XLogP0.3
Topological Polar Surface Area20.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Heavy Atom Count8
Formal Charge0
Complexity76
SMILES
CCN(CC)C(=O)C
InChI
InChI=1S/C6H13NO/c1-4-7(5-2)6(3)8/h4-5H2,1-3H3
InChIKey
AJFDBNQQDYLMJN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N,N-Diethylacetamide
CAS: 685-91-6
CID: 12703
Formula: C6H13NO
MW: 115.17
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight115.17
XLogP30.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass115.099714038
Monoisotopic Mass115.099714038
Topological Polar Surface Area20.3 Ų
Heavy Atom Count8
Formal Charge0
Complexity76.6
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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