Welcome to LookChem.com Sign In|Join Free
  • or
Home > Products >  > 

5-Methoxygramine

Related Products

Hot Products

Name

5-Methoxygramine

EINECS 240-669-8
CAS No. 16620-52-3 Density 1.12 g/cm3
PSA 28.26000 LogP 2.23810
Solubility N/A Melting Point 123-126 °C(lit.)
Formula C12H16N2O Boiling Point 334.677 °C at 760 mmHg
Molecular Weight 204.272 Flash Point 156.207 °C
Transport Information N/A Appearance white to almost white crystalline powder
Safety 22-24/25 Risk Codes 34-22
Molecular Structure Molecular Structure of 16620-52-3 (5-METHOXYGRAMINE) Hazard Symbols CorrosiveC,IrritantXi
Synonyms

Indole,3-[(dimethylamino)methyl]-5-methoxy- (7CI,8CI);3-Dimethylaminomethyl-5-methoxyindole;5-Methoxygramine;NSC 88885;

Article Data 14

5-Methoxygramine Specification

The IUPAC name of 5-Methoxygramine is 1-(5-methoxy-1H-indol-3-yl)-N,N-dimethylmethanamine. With the CAS registry number 16620-52-3, it is also named as 3-(Dimethylaminomethyl)-5-methoxyindole. The product's categories are Indoles and Derivatives; Indoline & Oxindole; Heterocyclic Compounds. Besides, it is white to almost white crystalline powder, which should be closed in a cool and dry place at 4 °C. In addition, its molecular formula is C12H16N2O and molecular weight is 204.27.

The other characteristics of this product can be summarized as: (1)EINECS: 240-669-8; (2)ACD/LogP: 1.82; (3)# of Rule of 5 Violations: 0; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 2.35; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 28.26 Å2; (12)Index of Refraction: 1.608; (13)Molar Refractivity: 63.11 cm3; (14)Molar Volume: 182.4 cm3; (15)Polarizability: 25.01×10-24cm3; (16)Surface Tension: 43.8 dyne/cm; (17)Density: 1.119 g/cm3; (18)Flash Point: 156.2 °C; (19)Melting Point: 123-126 °C; (20)Enthalpy of Vaporization: 57.77 kJ/mol; (21)Boiling Point: 334.7 °C at 760 mmHg; (22)Vapour Pressure: 0.000126 mmHg at 25 °C.

Preparation of 5-Methoxygramine: this chemical can be prepared by the reaction of 5-methoxy-indole with dimethylamine and formaldehyde.



The yield is 78 %.

Uses of 5-Methoxygramine: it can react with nitromethane to get 5-methoxy-3-(2-nitro-ethyl)-indole.



This reaction needs NaOMe, Me2SO4 and methanol for 24 hours. The yield is 98 %.

When you are using this chemical, please be cautious about it as the following: it may cause burns. It is also harmful if swallowed. Please do not breathe dust. And you should avoid contact with skin and eyes.

People can use the following data to convert to the molecule structure.
(1)SMILES: CN(C)Cc1cc2cc(ccc2n1)OC
(2)InChI: InChI=1/C12H16N2O/c1-14(2)8-10-6-9-7-11(15-3)4-5-12(9)13-10/h4-7,13H,8H2,1-3H3
(3)InChIKey: YSKVDCRGHJSLGZ-UHFFFAOYAU
(4)Std. InChI: InChI=1S/C12H16N2O/c1-14(2)8-10-6-9-7-11(15-3)4-5-12(9)13-10/h4-7,13H,8H2,1-3H3
(5)Std. InChIKey: YSKVDCRGHJSLGZ-UHFFFAOYSA-N

The toxicity data is as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 130mg/kg (130mg/kg)   Psychopharmacologia Vol. 16, Pg. 385, 1970.
mouse LD50 intravenous 56mg/kg (56mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#04863,

Post a RFQ

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

1

What can I do for you?
Get Best Price

Get Best Price for 16620-52-3