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Cas Database

Name	2,3-Dimethoxybenzylamine	EINECS	224-515-7
CAS No.	4393-09-3	Density	1.062 g/cm³
PSA	44.48000	LogP	1.86280
Solubility	N/A	Melting Point	229-230 °C(Solv: N,N-dimethylformamide (68-12-2))
Formula	C₉H₁₃NO₂	Boiling Point	269.8 °C at 760 mmHg
Molecular Weight	167.208	Flash Point	113.5 °C
Transport Information	N/A	Appearance	Colorless to light yellow liquid
Safety	26-37/39	Risk Codes	36/37/38
Molecular Structure		Hazard Symbols	Xi
Synonyms	(2,3-Dimethoxyphenyl)methanamine;2,3-Dimethoxybenzylamine;Benzylamine, 2,3-dimethoxy-;[(2,3-Dimethoxyphenyl)methyl]amine;o-Veratrylamine;	Article Data	9

2,3-Dimethoxybenzylamine Synthetic route

: 5470-95-1
oxime of 2,3-dimethoxy-benzaldehyde

: 4393-09-3
2,3-dimethoxybenzyl amine

Conditions

Conditions	Yield
With sodium amalgam; acetic acid at 40 - 50℃;
With lithium aluminium tetrahydride

: 5653-62-3
2,3-dimethoxybenzonitrile

: 4393-09-3
2,3-dimethoxybenzyl amine

Conditions

Conditions	Yield
With sodium hydroxide; hydrogen; sodium chloride; platinum(IV) oxide 1.) ethanol, chloroform, 40 psi, 3 h; Yield given. Multistep reaction;

: 86-51-1
2,3-dimethyoxybenzaldehyde

: 4393-09-3
2,3-dimethoxybenzyl amine

Conditions

Conditions	Yield
Stage #1: 2,3-dimethyoxybenzaldehyde In trimethyl orthoformate at 25℃; Stage #2: With lithium borohydride In tetrahydrofuran at 65℃; for 5h; Stage #3: With trifluoroacetic acid In dichloromethane at 25℃; for 5h;

: C9H12NO2Pol

: 4393-09-3
2,3-dimethoxybenzyl amine

Conditions

Conditions	Yield
With trifluoroacetic acid In dichloromethane at 25℃; for 5h; ((9-(amino)xanthen-2-yl)oxy)butanoic acid handle, p-methylbenzhydrylamine resin (H2N-XAL-MBHA resin);

: C9H10NO2Pol

: 4393-09-3
2,3-dimethoxybenzyl amine

Conditions

Conditions	Yield
Stage #1: C9H10NO2Pol With lithium borohydride In tetrahydrofuran at 65℃; for 5h; Stage #2: With trifluoroacetic acid In dichloromethane at 25℃; for 5h;

: 69912-63-6
boc-β-methoxyalanine dicyclohexylamine

: 4393-09-3
2,3-dimethoxybenzyl amine

: tert-butyl (S)-(1-((2,3-dimethoxybenzyl)amino)-3-methoxy-1-oxopropan-2-yl)carbamate

Conditions

Conditions	Yield
In ethyl acetate	100%

: 4393-09-3
2,3-dimethoxybenzyl amine

: 71989-31-6
Fmoc-Pro-OH

: 866824-06-8
2-(2,3-dimethoxy-benzylcarbamoyl)-pyrrolidine-1-carboxylic acid 9H-fluoren-9-ylmethyl ester

Conditions

Conditions	Yield
Stage #1: Fmoc-Pro-OH With O-(1H-benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium hexafluorophosphate; N-ethyl-N,N-diisopropylamine In acetonitrile at 20℃; for 0.333333h; Stage #2: 2,3-dimethoxybenzyl amine In acetonitrile at 20℃;	99%

: 4393-09-3
2,3-dimethoxybenzyl amine

α-bromoacetophenone: α-bromoacetophenone

: 2-(2,3-dimethoxyphenyl)-5-phenyloxazole

Conditions

Conditions	Yield
With iodine; potassium carbonate In N,N-dimethyl-formamide for 18h; Heating;	99%

: 209961-35-3
8-(2,3-dimethoxy-benzoylamino)-octanoic acid

: 4393-09-3
2,3-dimethoxybenzyl amine

: 773156-68-6
N-[7-(2,3-dimethoxy-benzylcarbamoyl)-heptyl]-2,3-dimethoxy-benzamide

Conditions

Conditions	Yield
Stage #1: 8-(2,3-dimethoxy-benzoylamino)-octanoic acid With O-(1H-benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium hexafluorophosphate; N-ethyl-N,N-diisopropylamine In acetonitrile for 0.5h; Stage #2: 2,3-dimethoxybenzyl amine In acetonitrile	96%

: 4393-09-3
2,3-dimethoxybenzyl amine

: 71989-16-7
Fmoc-Asn-OH

: 857064-44-9
[2-carbamoyl-1-(2,3-dimethoxy-benzylcarbamoyl)-ethyl]-carbamic acid 9H-fluoren-9-ylmethyl ester

Conditions

Conditions	Yield
Stage #1: Fmoc-Asn-OH With O-(1H-benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium hexafluorophosphate; N-ethyl-N,N-diisopropylamine In acetonitrile at 20℃; for 0.333333h; Stage #2: 2,3-dimethoxybenzyl amine In acetonitrile at 20℃;	95%

2,3-Dimethoxybenzylamine Specification

The cas register number of 2,3-Dimethoxybenzylamine is 4393-09-3. It also can be called as Benzenemethanamine,2,3-dimethoxy- and the IUPAC Name about this chemical is (2,3-dimethoxyphenyl)methanamine. It belongs to the following product categories, such as Anilines, Aromatic Amines and Nitro Compounds, Amine, Amines, C9 to C10, Nitrogen Compounds and so on.

Physical properties about 2,3-Dimethoxybenzylamine are: (1)ACD/LogP: 0.83; (2)ACD/LogD (pH 5.5): -2.17; (3)ACD/LogD (pH 7.4): -0.95; (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): 1.13; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 4; (11)Polar Surface Area: 21.7Å²; (12)Index of Refraction: 1.522; (13)Molar Refractivity: 48.06 cm³; (14)Molar Volume: 157.4 cm³; (15)Polarizability: 19.05x10^-24cm³; (16)Surface Tension: 36.3 dyne/cm; (17)Enthalpy of Vaporization: 50.8 kJ/mol; (18)Vapour Pressure: 0.00709 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: COC1=CC=CC(=C1OC)CN
(2)InChI: InChI=1S/C9H13NO2/c1-11-8-5-3-4-7(6-10)9(8)12-2/h3-5H,6,10H2,1-2H3
(3)InChIKey: LVMPWFJVYMXSNY-UHFFFAOYSA-N

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