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N-Ethylisopropylamine

CAT: 0572-TRC-E921950-5GSize: 5 gDry Ice: NoHazardous: Yes
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CAT#:0572-TRC-E921950-5GSize:5 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
19961-27-4
Synonyms
N-Ethyl-2-propanamine; 1-Methyldiethylamine; (Ethyl)(1-methylethyl)amine; 2-(Ethylamino)propane; Ethylisopropylamine; Isopropylethylamine; N-Ethyl-2-propanamine; N-Ethyl-N-isopropylamine; NSC 165659;
Hazard Statement
Highly flammable liquid and vapour; UN number: UN2733; Packing Group: II
Smiles
CCNC(C)C
Molecular Formula
C5H13N
Molecular Weight
87.16
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Isopropylethylamine
CAS Number19961-27-4
PubChem CID88318
IUPAC NameN-ethylpropan-2-amine
Molecular FormulaC5H13N
Molecular Weight87.16
XLogP0.9
Topological Polar Surface Area12
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Heavy Atom Count6
Formal Charge0
Complexity25
SMILES
CCNC(C)C
InChI
InChI=1S/C5H13N/c1-4-6-5(2)3/h5-6H,4H2,1-3H3
InChIKey
RIVIDPPYRINTTH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Isopropylethylamine
CAS: 19961-27-4
CID: 88318
Formula: C5H13N
MW: 87.16
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight87.16
XLogP30.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass87.104799419
Monoisotopic Mass87.104799419
Topological Polar Surface Area12 Ų
Heavy Atom Count6
Formal Charge0
Complexity25.1
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