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2,3-Dimethoxybenzylamine

2,3-Dimethoxybenzylamine structure

CAS No:
4393-09-3
Formula:
C9H13NO2
Chemical Name:
2,3-Dimethoxybenzylamine
Synonyms:
Benzenemethanamine,2,3-dimethoxy-;2,3-Dimethoxybenzenemethanamine;o-Veratrylamine;Benzylamine,2,3-dimethoxy-;2,3-Dimethoxybenzylamine;[(2,3-Dimethoxyphenyl)methyl]amine;(2,3-Dimethoxyphenyl)methanamine
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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Description

Colorless to light yellowliqui

2,3-Dimethoxybenzylamine Basic Attributes

Molecular Weight：

167.208

Exact Mass：

167.21

EC Number：

224-515-7

DSSTox ID：

DTXSID90195994

HScode：

2922299090

Characteristics

PSA：

44.5

XLogP3：

0.7

Appearance：

Colorless to light yellow liquid

Density：

1.1243 g/cm³ @ Temp: 0 °C

Melting Point：

229-230 °C @ Solvent: Dimethylformamide

Boiling Point：

137 °C @ Press: 11 Torr

Flash Point：

113.5±30.4 °C

Refractive Index：

1.523

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

R36/37/38

safety instructions：

S26-S37/39

Marks：

Xi:Irritant;

Precautionary statement(s)：

P261-P305 + P351 + P338

Hazard Statements：

H315-H319-H335

GHS Classification：

|Warning|H315 (95.24%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 42 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:167.20
XLogP3:0.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:167.094628657
Monoisotopic Mass:167.094628657
Topological Polar Surface Area:44.5
Heavy Atom Count:12
Complexity:130
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes