Skip to the beginning of the images gallery

3,4,5-Trimethoxybenzylamine - 97%, high purity , CAS No.18638-99-8

COA

Grade & Purity:

≥97%

Cas Number: 18638-99-8
Molecular Weight: 197.23
EC Number: 242-468-0
MDL number: MFCD00017150
PubChem CID: 87736

In stock

Item Number

W132934

Grouped product items
SKU	Size	Availability	Price
W132934-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$12.90
W132934-5g	5g	2	$47.90
W132934-25g	25g	1	$182.90
W132934-100g	100g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$656.90

View related series

Nitrogenous compounds (2445) Non heterocyclic block (8163)

Basic Description

Synonyms	FMOC-(S)-b-(p-methoxyphenyl)alanine \| UNII-5DZ6S2AB35 \| 5DZ6S2AB35 \| NCIOpen2_001669 \| 3,4,5-Trimethoxybenzylamine, 98% \| STK873740 \| W0S \| 1,3-Isobenzofurandione, hexahydro-, cis- \| 1-(3,4,5-trimethoxyphenyl)methanamine \| (3,4,5-Trimethoxyphenyl)methanam
Specifications & Purity	≥97%
Storage Temp	Argon charged
Shipped In	Normal
Product Description	3,4,5-Trimethoxybenzylamine was used in the synthesis of benzyl 3-deoxy-3-(3,4,5-trimethoxybenzylamino)-β-L−xylopyranoside.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Phenylmethylamines

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Phenylmethylamines
Intermediate Tree Nodes	Not available
Direct Parent	Phenylmethylamines
Alternative Parents	Phenoxy compounds Methoxybenzenes Benzylamines Anisoles Aralkylamines Alkyl aryl ethers Organopnictogen compounds Monoalkylamines Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Anisole - Benzylamine - Phenol ether - Phenylmethylamine - Methoxybenzene - Phenoxy compound - Aralkylamine - Alkyl aryl ether - Ether - Primary amine - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Amine - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as phenylmethylamines. These are compounds containing a phenylmethtylamine moiety, which consists of a phenyl group substituted by an methanamine.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

IUPAC Name	(3,4,5-trimethoxyphenyl)methanamine
INCHI	InChI=1S/C10H15NO3/c1-12-8-4-7(6-11)5-9(13-2)10(8)14-3/h4-5H,6,11H2,1-3H3
InChIKey	YUPUSBMJCFBHAP-UHFFFAOYSA-N
Smiles	COC1=CC(=CC(=C1OC)OC)CN
Isomeric SMILES	COC1=CC(=CC(=C1OC)OC)CN
WGK Germany	3
PubChem CID	87736
Molecular Weight	197.23
Reaxy-Rn	1107570

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

4 results found

Lot Number	Certificate Type	Date	Item
A1513071	Certificate of Analysis	Sep 14, 2022	W132934
B2225018	Certificate of Analysis	Feb 28, 2022	W132934
B2224606	Certificate of Analysis	Feb 28, 2022	W132934
B2224605	Certificate of Analysis	Feb 28, 2022	W132934

Chemical and Physical Properties

Solubility	Not miscible or difficult to mix in water.
Sensitivity	Air Sensitive
Refractive Index	1.55
Flash Point(°F)	235.4 °F
Flash Point(°C)	113 °C
Boil Point(°C)	121 °C/0.05 mmHg
Molecular Weight	197.230 g/mol
XLogP3	0.300
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Exact Mass	197.105 Da
Monoisotopic Mass	197.105 Da
Topological Polar Surface Area	53.700 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	151.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

Solution Calculators

Molarity Calculator

Determine the necessary mass, volume, or concentration for preparing a solution.

Mass

Concentration

Volume

M. Wt*

g/mol

*When preparing stock solutions, always use the batch-specific molecular weight of the product found on the vial label and the Certificate of Analysis (available online).

Dilution Calculator

Determine the dilution needed to prepare a stock solution.

Concentration 1 (C1)

Volume 1 (V1)

Concentration 2 (C2)

Volume 2 (V2)

Reconstitution Calculator

The reconstitution calculator enables you to quickly determine the volume of a reagent needed to reconstitute your vial. Just enter the mass of the reagent and the target concentration, and the calculator will do the rest.

Volume (to add to vial)

Mass (in vial)

Desired Reconstitution Concentration