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Tryptamine, free base

CAT: 0926-T-8100-02Size: 0.5 KgDry Ice: NoHazardous: No
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CAT#:0926-T-8100-02Size:0.5 Kg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
61-54-1
Synonyms
3- (2-Aminoethyl) indole
MDL Number
MFCD00005661
Smiles
C1=CC=C2C (=C1) C (=CN2) CCN
Molecular Formula
C10H12N2
Molecular Weight
160.22 g/mol
Controlled
No

Chemical Information

Tryptamine

Tryptamine is an aminoalkylindole consisting of indole having a 2-aminoethyl group at the 3-position. It has a role as a mouse metabolite, a plant metabolite and a human metabolite. It is a member of tryptamines, an aminoalkylindole, an indole alkaloid and an aralkylamino compound. It is a conjugate base of a tryptaminium.

CAS Number61-54-1
PubChem CID1150
IUPAC Name2-(1H-indol-3-yl)ethanamine
Molecular FormulaC10H12N2
Molecular Weight160.22
XLogP1.6
Topological Polar Surface Area41.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Heavy Atom Count12
Formal Charge0
Complexity147
SMILES
C1=CC=C2C(=C1)C(=CN2)CCN
InChI
InChI=1S/C10H12N2/c11-6-5-8-7-12-10-4-2-1-3-9(8)10/h1-4,7,12H,5-6,11H2
InChIKey
APJYDQYYACXCRM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Tryptamine
CAS: 61-54-1
CID: 1150
Formula: C10H12N2
MW: 160.22
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight160.22
XLogP31.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass160.100048391
Monoisotopic Mass160.100048391
Topological Polar Surface Area41.8 Ų
Heavy Atom Count12
Formal Charge0
Complexity147
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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