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(Benzyloxy) (ethyl) amine

CAT: 0926-UAA20759-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0926-UAA20759-01Size:100 mg
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CAS Number
19207-59-1
MDL Number
MFCD20930350
Smiles
CCNOCC1=CC=CC=C1
Molecular Formula
C9H13NO
Molecular Weight
151.21 g/mol
Controlled
No

Chemical Information

(Benzyloxy)(ethyl)amine
CAS Number19207-59-1
PubChem CID251744
IUPAC NameN-phenylmethoxyethanamine
Molecular FormulaC9H13NO
Molecular Weight151.21
XLogP1.7
Topological Polar Surface Area21.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Heavy Atom Count11
Formal Charge0
Complexity89
SMILES
CCNOCC1=CC=CC=C1
InChI
InChI=1S/C9H13NO/c1-2-10-11-8-9-6-4-3-5-7-9/h3-7,10H,2,8H2,1H3
InChIKey
YUESULCDVWCTSX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of (Benzyloxy)(ethyl)amine
CAS: 19207-59-1
CID: 251744
Formula: C9H13NO
MW: 151.21
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight151.21
XLogP31.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass151.099714038
Monoisotopic Mass151.099714038
Topological Polar Surface Area21.3 Ų
Heavy Atom Count11
Formal Charge0
Complexity89.6
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