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2-(Methyleneamino)acetonitrile

2-(Methyleneamino)acetonitrile structure

2-(Methyleneamino)acetonitrile 

structure
  • CAS No:

    109-82-0

  • Formula:

    C3H4N2

  • Chemical Name:

    2-(Methyleneamino)acetonitrile

  • Synonyms:

    Acetonitrile,2-(methyleneamino)-;Acetonitrile,(methyleneamino)-;Glycinonitrile,N-methylene-;2-(Methyleneamino)acetonitrile;N-methylene-glycinonitrile;MAAN;Methyleneaminoacetonitrile;NSC 128385;NSC 3486;NSC 57883;2-(Methylideneamino)acetonitrile

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

Description

WHITE CRYSTALS

2-(Methyleneamino)acetonitrile Basic Attributes

68.08

68.08

1848155

203-709-5

VUC4O8Q6RO

128385|57883|3486

DTXSID0059378

2926909090

Characteristics

36.2

0.42

White crystals

0.8765 (rough estimate)

129 °C

106.45°C (rough estimate)

45.2±27.3 °C

1.4089 (estimate)

Store in a cool, dry place. Store in a tightly closed container.

3.71mmHg at 25°C

Safety Information

I; II; III

6.1

36/37/38-20/21/22

36/37/39-26-22

MC1925000

Xn

P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, P501

H302

|Warning|H302 (95.92%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 98 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

2-(Methyleneamino)acetonitrile Use and Manufacturing

Methods of Manufacturing

Under the condition of stirring and maintaining 0°C, the sodium cyanide aqueous solution was added to the mixture of formaldehyde and ammonium chloride, and glacial acetic acid was added dropwise during the feeding. After the addition, stir for 1.5h, filter the precipitate, wash with water, and dry to obtain methyleneaminoacetonitrile with a yield of 61-71%.

Uses

Organic synthesis intermediate

Acetonitrile, 2-(methyleneamino)-: INACTIVE

Computed Properties

Molecular Weight:68.08
XLogP3:1.3
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:68.037448136
Monoisotopic Mass:68.037448136
Topological Polar Surface Area:36.2
Heavy Atom Count:5
Complexity:66.2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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