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[2- (Ethoxymethyl) phenyl]methanamine

CAT: 0926-DBA83792-01Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0926-DBA83792-01Size:250 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
28837-92-5
MDL Number
MFCD09739137
Smiles
CCOCC1=CC=CC=C1CN
Molecular Formula
C10H15NO
Molecular Weight
165.23 g/mol
Controlled
No

Chemical Information

[2-(Ethoxymethyl)phenyl]methanamine
CAS Number28837-92-5
PubChem CID16792336
IUPAC Name[2-(ethoxymethyl)phenyl]methanamine
Molecular FormulaC10H15NO
Molecular Weight165.23
XLogP0.8
Topological Polar Surface Area35.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Heavy Atom Count12
Formal Charge0
Complexity116
SMILES
CCOCC1=CC=CC=C1CN
InChI
InChI=1S/C10H15NO/c1-2-12-8-10-6-4-3-5-9(10)7-11/h3-6H,2,7-8,11H2,1H3
InChIKey
XRHPSGUGMIFVLP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of [2-(Ethoxymethyl)phenyl]methanamine
CAS: 28837-92-5
CID: 16792336
Formula: C10H15NO
MW: 165.23
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight165.23
XLogP30.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass165.115364102
Monoisotopic Mass165.115364102
Topological Polar Surface Area35.3 Ų
Heavy Atom Count12
Formal Charge0
Complexity116
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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