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Home > Encyclopedia > Benzenemethanamine, 4-nitro-, hydrochloride (1:1)

Benzenemethanamine, 4-nitro-, hydrochloride (1:1)

Benzenemethanamine, 4-nitro-, hydrochloride (1:1) structure

Benzenemethanamine, 4-nitro-, hydrochloride (1:1) 

structure
  • CAS No:

    18600-42-5

  • Formula:

    C7H8N2O2.ClH

  • Chemical Name:

    Benzenemethanamine, 4-nitro-, hydrochloride (1:1)

  • Synonyms:

    Benzenemethanamine,4-nitro-,hydrochloride (1:1);Benzylamine,p-nitro-,monohydrochloride;Benzenemethanamine,4-nitro-,monohydrochloride;Benzylamine,p-nitro-,hydrochloride;p-Nitrobenzylamine hydrochloride;4-Nitrobenzylamine hydrochloride;4-Nitrobenzenemethanamine hydrochloride;(4-Nitrophenyl)methanamine hydrochloride

  • Categories:

    Organic Chemistry  >  Amides

Description

light brown crystalline solid

Benzenemethanamine, 4-nitro-, hydrochloride (1:1) Basic Attributes

188.61

188.035248

3629994

242-441-3

29214990

Characteristics

71.8

225 °C

133.7ºC

H2O: almost transparency;methanol:glacial acetic acid (1:1): soluble 25mg/mL, clear, colorless to light yellow

Safety Information

III

6.1(b)

2811

3

36/37/38

26-36

DP6705000

Xi,T

Stable. Incompatible with acids, acid chlorides, acid anhydrides, oxidizing agents.

P261-P305 + P351 + P338

H315-H319-H335

|Warning|H315 (100%): 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 44 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Benzenemethanamine, 4-nitro-, hydrochloride (1:1) Use and Manufacturing

General procedure: To a nitrogen purged screw-caped vial containing 1a (1.0 g, 5.1 mmol, 1.0 equiv) in 6.0 mL of toluene were added TMDS (900 μL, 5.1 mmol, 1.0 equiv) or PMHS (610 μL, 10.2 mmol, 2.0 equiv) and Ti(Oi-Pr)

Computed Properties

Molecular Weight:188.61
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:188.0352552
Monoisotopic Mass:188.0352552
Topological Polar Surface Area:73.5
Heavy Atom Count:12
Complexity:136
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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