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3,4-Dimethoxybenzenepropanamine

CAT: 0931-T125814-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0931-T125814-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
14773-42-3
Target
Others
Related Pathways
Others
Bioactivity
3,4-Dimethoxybenzenepropanamine is a useful organic compound for research related to life sciences. The catalog number is T125814 and the CAS number is 14773-42-3.
Smiles
COC1=C(OC)C=C(CCCN)C=C1
Molecular Formula
C11H17NO2
Molecular Weight
195.2582
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

3,4-Dimethoxybenzenepropanamine

See also: 3-(3,4-Dimethoxy-phenyl)propylamine (annotation moved to).

CAS Number14773-42-3
PubChem CID2281053
IUPAC Name3-(3,4-dimethoxyphenyl)propan-1-amine
Molecular FormulaC11H17NO2
Molecular Weight195.26
XLogP1.1
Topological Polar Surface Area44.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Heavy Atom Count14
Formal Charge0
Complexity152
SMILES
COC1=C(C=C(C=C1)CCCN)OC
InChI
InChI=1S/C11H17NO2/c1-13-10-6-5-9(4-3-7-12)8-11(10)14-2/h5-6,8H,3-4,7,12H2,1-2H3
InChIKey
WYYQSKUMIFPNFW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3,4-Dimethoxybenzenepropanamine
CAS: 14773-42-3
CID: 2281053
Formula: C11H17NO2
MW: 195.26
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight195.26
XLogP31.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Exact Mass195.125928785
Monoisotopic Mass195.125928785
Topological Polar Surface Area44.5 Ų
Heavy Atom Count14
Formal Charge0
Complexity152
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
GTR19228132-013,4-Dimethoxybenzenepropanamine
B810001Butyric Anhydride-3,3,3',3',4,4,4,4',4',4'-d10
HY-W009390S-01DL-Homocystine-3,3,3’,3’,4,4,4’,4’-d8
sc-480128ADL-Homocystine-3,3,3′,3′,4,4,4′,4′-d8
TRC-H591292-250MGDL-Homocystine-3,3,3',3',4,4,4',4'-d8
TRC-H591362-1MGL-Homocystine-3,3,3’,3’,4,4,4’,4’-d8
PC496243,3,4,4,4-Pentafluorobutylamine
PAA047093,3,4,4-Tetrachloroazobenzene
RG-A262638-013,4,3',4'- Tetrabromobiphenyl
sc-3226513,3',4,4'-Tetrachlorobenzophenone

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