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N, N-Dimethylhexanamide

CAT: 0286-D40840Size: 10 gDry Ice: NoHazardous: No
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CAT#:0286-D40840Size:10 g
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CAS Number
5830-30-8
Synonyms
N, N-Dimethylcaproamide
Pictogram
07 - Irritant
UDF Signal Word
Warning
MDL Number
MFCD00043671
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

N,N-Dimethylhexanamide
CAS Number5830-30-8
PubChem CID22084
IUPAC NameN,N-dimethylhexanamide
Molecular FormulaC8H17NO
Molecular Weight143.23
XLogP1.6
Topological Polar Surface Area20.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count4
Heavy Atom Count10
Formal Charge0
Complexity99
SMILES
CCCCCC(=O)N(C)C
InChI
InChI=1S/C8H17NO/c1-4-5-6-7-8(10)9(2)3/h4-7H2,1-3H3
InChIKey
OAERLTPBKQBWHJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N,N-Dimethylhexanamide
CAS: 5830-30-8
CID: 22084
Formula: C8H17NO
MW: 143.23
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight143.23
XLogP31.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count4
Exact Mass143.131014166
Monoisotopic Mass143.131014166
Topological Polar Surface Area20.3 Ų
Heavy Atom Count10
Formal Charge0
Complexity99.4
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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CatalogName
sc-471369N, N-Dimethylhexanamide
BAA85717-016-Amino-N, N-dimethylhexanamide
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