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2,6-Dimethylbenzylamine

2,6-Dimethylbenzylamine structure

CAS No:
74788-82-2
Formula:
C9H13N
Chemical Name:
2,6-Dimethylbenzylamine
Synonyms:
2,6-Dimethylbenzylamine;2,6-Dimethylbenzylam;(2,6-Dimethylphenyl)methylamine, 2-(Methylamino)-m-xylene;2,6-DiMethylbenzeneMethanaMine
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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2,6-Dimethylbenzylamine Basic Attributes

Molecular Weight：

135.21

Exact Mass：

135.104797

DSSTox ID：

DTXSID10504685

HScode：

2921499090

Characteristics

PSA：

XLogP3：

1.5

Density：

1.0±0.1 g/cm3

Flash Point：

94.1±8.5 °C

Refractive Index：

1.537

Safety Information

Precautionary statement(s)：

P260, P261, P264, P270, P271, P280, P301+P312, P301+P330+P331, P302+P352, P303+P361+P353, P304+P312, P304+P340, P305+P351+P338, P310, P312, P321, P322, P330, P363, P405, P501

Hazard Statements：

H302

GHS Classification：

|Danger|H302 (66.67%): Harmful if swallowed [Warning Acute toxicity, oral]|P260, P261, P264, P270, P271, P280, P301+P312, P301+P330+P331, P302+P352, P303+P361+P353, P304+P312, P304+P340, P305+P351+P338, P310, P312, P321, P322, P330, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 3 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

2,6-Dimethylbenzylamine Use and Manufacturing

2,5-Dimethylbenzylamine is an intermediate in the synthesis of flavin derivatives for therapeutic use as anti-infective agents.

Computed Properties

Molecular Weight:135.21
XLogP3:1.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:135.104799419
Monoisotopic Mass:135.104799419
Topological Polar Surface Area:26
Heavy Atom Count:10
Complexity:90.9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes