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3-(2-ethoxyphenyl)propan-1-amine

3-(2-ethoxyphenyl)propan-1-amine

CAS: 937653-39-9

Formula: C11H17NO

SMILES: CCOC1=C(CCCN)C=CC=C1

IUPAC: 3-(2-ethoxyphenyl)propan-1-amine

InChI: InChI=1S/C11H17NO/c1-2-13-11-8-4-3-6-10(11)7-5-9-12/h3-4,6,8H,2,5,7,9,12H2,1H3

Composition: C (73.70%), H (9.56%), N (7.81%), O (8.92%)

Molar Mass: 179.263

Atom Count: 30

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 179.131014171
Formal Charge 0
FSP3 0.45
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey ITVNSLFHPCLQQF-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 55.1
Topological Polar Surface Area 35.25
Polarizability 21.68
Ring Count 1
Rotatable Bond Count 5

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