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3-Bromoamphetamine hydrochloride

CAT: 0931-T206868-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-T206868-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1210708-61-4
Target
Monoamine Transporter
Related Pathways
Membrane transporter/Ion channel
Bioactivity
3-Bromoamphetamine hydrochloride is a para-substituted amphetamine that functions as a monoamine releaser.
Smiles
Cl.BrC1=CC=CC(=C1)CC(N)C
Molecular Formula
C9H13BrClN
Molecular Weight
250.563
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

1-(3-Bromophenyl)propan-2-amine hydrochloride
CAS Number1210708-61-4
PubChem CID45792489
IUPAC Name1-(3-bromophenyl)propan-2-amine;hydrochloride
Molecular FormulaC9H13BrClN
Molecular Weight250.56
Topological Polar Surface Area26
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Heavy Atom Count12
Formal Charge0
Complexity116
SMILES
CC(CC1=CC(=CC=C1)Br)N.Cl
InChI
InChI=1S/C9H12BrN.ClH/c1-7(11)5-8-3-2-4-9(10)6-8;/h2-4,6-7H,5,11H2,1H3;1H
InChIKey
KMTKDPOKDRPBLF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-(3-Bromophenyl)propan-2-amine hydrochloride
CAS: 1210708-61-4
CID: 45792489
Formula: C9H13BrClN
MW: 250.56
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight250.56
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass248.99199
Monoisotopic Mass248.99199
Topological Polar Surface Area26 Ų
Heavy Atom Count12
Formal Charge0
Complexity116
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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