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Phenylpropylmethylamine HCl

CAT: 1596-AR-P01552-01Size: 10 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-P01552-01Size:10 Units
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CAS Number
5969-39-1
Synonyms
N-methyl-2-phenylpropan-1-amine hydrochloride; N, ?-Dimethylbenzeneethanamine Hydrochloride; N, ?-Dimethylphenethylamine Hydrochloride; 1-Methylamino-2-methyl-2-phenylethane Hydrochloride; 1-Methylamino-2-phenylpropane Hydrochloride; Phenpromethamine Hydrochloride; Vonedrine Hydrochloride; dl-N, ?-Dimethylphenethylamine Hydrochloride; Phenylpropylmethylamine Hydrochloride
Molecular Formula
C10H15N. HCl
Molecular Weight
149.24 36.46
API Name
Phenethylamine

Chemical Information

Phenpromethamine hydrochloride
CAS Number5969-39-1
PubChem CID22275
IUPAC NameN-methyl-2-phenylpropan-1-amine;hydrochloride
Molecular FormulaC10H16ClN
Molecular Weight185.69
Topological Polar Surface Area12
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count1
Rotatable Bond Count3
Heavy Atom Count12
Formal Charge0
Complexity95
SMILES
CC(CNC)C1=CC=CC=C1.Cl
InChI
InChI=1S/C10H15N.ClH/c1-9(8-11-2)10-6-4-3-5-7-10;/h3-7,9,11H,8H2,1-2H3;1H
InChIKey
OQHDRLTXPGYYJN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Phenpromethamine hydrochloride
CAS: 5969-39-1
CID: 22275
Formula: C10H16ClN
MW: 185.69
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight185.69
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count1
Rotatable Bond Count3
Exact Mass185.0971272
Monoisotopic Mass185.0971272
Topological Polar Surface Area12 Ų
Heavy Atom Count12
Formal Charge0
Complexity95
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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