Tryptamine Impurity 3

CAT: 1596-AR-T06119-06Size: 250 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-T06119-06Size:250 Units

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

2433-31-0

Molecular Formula

C13H18N2O2

Molecular Weight

234.30

API Name

Tryptamine

Chemical Information

3-(2-(Dimethylamino)ethyl)-5-methoxy-1H-indol-4-ol

CAS Number	2433-31-0
PubChem CID	57459769
IUPAC Name	3-[2-(dimethylamino)ethyl]-5-methoxy-1H-indol-4-ol
Molecular Formula	C13H18N2O2
Molecular Weight	234.29
XLogP	2
Topological Polar Surface Area	48.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Heavy Atom Count	17
Formal Charge	0
Complexity	248

SMILES

CN(C)CCC1=CNC2=C1C(=C(C=C2)OC)O

InChI

InChI=1S/C13H18N2O2/c1-15(2)7-6-9-8-14-10-4-5-11(17-3)13(16)12(9)10/h4-5,8,14,16H,6-7H2,1-3H3

InChIKey

YTBHRCRBKLRGBT-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2433-31-0

CID: 57459769

Formula: C13H18N2O2

MW: 234.29

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	234.29
XLogP3	2
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Exact Mass	234.136827821
Monoisotopic Mass	234.136827821
Topological Polar Surface Area	48.5 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	248
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
AR-T06122-01	Tryptamine Impurity 1-d4
AR-T06112-01	7-Methoxy-Tryptamine
AR-T06110-01	4-Methoxy-Tryptamine
AR-T06111-01	6-Methoxy-Tryptamine
AR-T03123-01	Tryptamine-d4 HCl
AR-T03125-01	6-Methoxy-N, N-Diisopropyl Tryptamine
AR-T03126-01	7-Methoxy-N, N-Diisopropyl Tryptamine
AR-T06120-01	2-Methyl-N, N-Dimethyl Tryptamine
AR-T03124-01	4-Methoxy-N, N-Diisopropyl Tryptamine
AR-T06114-01	5-Methoxy-N-methyl-N-isopropyl Tryptamine