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N-tert-Butylformamide 95%

CAT: 0286-B29018-01Size: 5 gDry Ice: NoHazardous: No
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CAT#:0286-B29018-01Size:5 g
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CAS Number
2425-74-3
Pictogram
07 - Irritant
UDF Signal Word
Warning
MDL Number
MFCD00003277
Hazard Statement
H302 Harmful if swallowed; H312 Harmful in contact with skin; H315 Causes skin irritation; H320 Causes eye irritation; H332 Harmful if inhaled; H335 May cause respiratory irritation.
DOT Name
Not D.O.T.-Regulated
Precautions
P261 Avoid breathing dust/fume/gas/mist/vapors/spray; 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-t-Butylformamide
CAS Number2425-74-3
PubChem CID17045
IUPAC NameN-tert-butylformamide
Molecular FormulaC5H11NO
Molecular Weight101.15
XLogP0.5
Topological Polar Surface Area29.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count7
Formal Charge0
Complexity63
SMILES
CC(C)(C)NC=O
InChI
InChI=1S/C5H11NO/c1-5(2,3)6-4-7/h4H,1-3H3,(H,6,7)
InChIKey
SDLAKRCBYGZJRW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-t-Butylformamide
CAS: 2425-74-3
CID: 17045
Formula: C5H11NO
MW: 101.15
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight101.15
XLogP30.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass101.084063974
Monoisotopic Mass101.084063974
Topological Polar Surface Area29.1 Ų
Heavy Atom Count7
Formal Charge0
Complexity63
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