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(Cyclopropylmethyl) (methyl) amine

CAT: 0127-OR902120-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0127-OR902120-01Size:100 mg
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CAS Number
18977-45-2
Synonyms
1-Cyclopropyl-N-methylmethanamine
MDL Number
MFCD11150443
Purity
98%
Smiles
CNCC1CC1
Storage Conditions
Store at -20°C

Chemical Information

(Cyclopropylmethyl)methylamine
CAS Number18977-45-2
PubChem CID12919209
IUPAC Name1-cyclopropyl-N-methylmethanamine
Molecular FormulaC5H11N
Molecular Weight85.15
XLogP0.5
Topological Polar Surface Area12
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Heavy Atom Count6
Formal Charge0
Complexity39
SMILES
CNCC1CC1
InChI
InChI=1S/C5H11N/c1-6-4-5-2-3-5/h5-6H,2-4H2,1H3
InChIKey
BFPMCZWKUSUMKE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of (Cyclopropylmethyl)methylamine
CAS: 18977-45-2
CID: 12919209
Formula: C5H11N
MW: 85.15
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight85.15
XLogP30.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass85.089149355
Monoisotopic Mass85.089149355
Topological Polar Surface Area12 Ų
Heavy Atom Count6
Formal Charge0
Complexity39.2
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