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Ethyl isonipecotate 98%

CAT: 0286-E11770-01Size: 25 gDry Ice: NoHazardous: No
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CAT#:0286-E11770-01Size:25 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1126-09-6
Synonyms
Piperidine-4-carboxylic acid ethyl ester; Ethyl piperidine-4-carboxylate; H-DL-Inp-OEt
Pictogram
07 - Irritant
UDF Signal Word
Warning
MDL Number
MFCD00006003
Hazard Statement
H227 Combustible liquid; H302 Harmful if swallowed; H312 Harmful in contact with skin; H315 Causes skin irritation; H319 Causes serious eye irritation; H332 Harmful if inhaled; H335 May cause respiratory irritation.
DOT Name
Not D.O.T.-Regulated
Precautions
P210 Keep away from heat/sparks/open flames/hot surfaces. — No smoking; 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

Ethyl 4-piperidinecarboxylate
CAS Number1126-09-6
PubChem CID70770
IUPAC Nameethyl piperidine-4-carboxylate
Molecular FormulaC8H15NO2
Molecular Weight157.21
XLogP0.5
Topological Polar Surface Area38.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count11
Formal Charge0
Complexity130
SMILES
CCOC(=O)C1CCNCC1
InChI
InChI=1S/C8H15NO2/c1-2-11-8(10)7-3-5-9-6-4-7/h7,9H,2-6H2,1H3
InChIKey
RUJPPJYDHHAEEK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Ethyl 4-piperidinecarboxylate
CAS: 1126-09-6
CID: 70770
Formula: C8H15NO2
MW: 157.21
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight157.21
XLogP30.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass157.110278721
Monoisotopic Mass157.110278721
Topological Polar Surface Area38.3 Ų
Heavy Atom Count11
Formal Charge0
Complexity130
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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