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Home > Encyclopedia > N-(Aminocarbonyl)-2-cyanoacetamide

N-(Aminocarbonyl)-2-cyanoacetamide

N-(Aminocarbonyl)-2-cyanoacetamide structure

N-(Aminocarbonyl)-2-cyanoacetamide 

structure
  • CAS No:

    1448-98-2

  • Formula:

    C4H5N3O2

  • Chemical Name:

    N-(Aminocarbonyl)-2-cyanoacetamide

  • Synonyms:

    Acetamide,N-(aminocarbonyl)-2-cyano-;Urea,(cyanoacetyl)-;N-(Aminocarbonyl)-2-cyanoacetamide;(Cyanoacetyl)urea;(2-Cyanoethanoyl)urea;NSC 6287;N-Carbamoyl-2-cyanoacetamide;(2-Cyanoacetyl)urea

  • Categories:

    Chemical Reagents  >  Organic Reagents

Description

white to off-white crystalline

N-(Aminocarbonyl)-2-cyanoacetamide Basic Attributes

127.1

127.10

1705616

215-906-3

6287

DTXSID7061697

29242100

Characteristics

96

-1.47

1.342±0.06 g/cm3(Predicted)

161 °C

1.497

Store below +30°C.

Safety Information

III

6.1

3276

25-36/37/38-20/21/22

20-26-36/37-45-60-37/39

Xn

P261, P264, P270, P271, P280, P301+P310, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, P501

H301

|Danger|H301 (20%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P310, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 5 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

N-(Aminocarbonyl)-2-cyanoacetamide Use and Manufacturing

Uses

Caffeine, SDM and other pharmaceutical intermediates.

Acetamide, N-(aminocarbonyl)-2-cyano-: ACTIVE

Computed Properties

Molecular Weight:127.10
XLogP3:-0.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:127.038176411
Monoisotopic Mass:127.038176411
Topological Polar Surface Area:96
Heavy Atom Count:9
Complexity:178
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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