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3-Methoxyphenylethylamine

CAT: 0931-T7855-02Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0931-T7855-02Size:500 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2039-67-0
Target
Others
Related Pathways
Others
Purity
0.98
Bioactivity
3-Methoxyphenylethylamine is a bioactive chemical.
Smiles
C(CN)C1=CC(OC)=CC=C1
Molecular Formula
C9H13NO
Molecular Weight
151.21
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

3-Methoxyphenethylamine
CAS Number2039-67-0
PubChem CID74866
IUPAC Name2-(3-methoxyphenyl)ethanamine
Molecular FormulaC9H13NO
Molecular Weight151.21
XLogP1.6
Topological Polar Surface Area35.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count11
Formal Charge0
Complexity106
SMILES
COC1=CC=CC(=C1)CCN
InChI
InChI=1S/C9H13NO/c1-11-9-4-2-3-8(7-9)5-6-10/h2-4,7H,5-6,10H2,1H3
InChIKey
WJBMRZAHTUFBGE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-Methoxyphenethylamine
CAS: 2039-67-0
CID: 74866
Formula: C9H13NO
MW: 151.21
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight151.21
XLogP31.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass151.099714038
Monoisotopic Mass151.099714038
Topological Polar Surface Area35.3 Ų
Heavy Atom Count11
Formal Charge0
Complexity106
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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Alternative Products

CatalogName
HY-41268-013-Methoxyphenylethylamine
CAA03954-013-Methoxyphenylethylamine hydrochloride
sc-2667233-Methoxyphenylethylamine HCl
4240253-Benzyloxy-4-methoxyphenylethylamine
PC68253,3,3-Trifluoropropyl 3,3,3-trifluoropropanoate
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sc-260433A3- (3,3,3-Trifluoropropyl) heptamethyltrisiloxane
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