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Isobutyramide

pharmaceutical raw materials
Isobutyramide structure

Isobutyramide 

structure
  • CAS No:

    563-83-7

  • Formula:

    C4H9NO

  • Chemical Name:

    Isobutyramide

  • Synonyms:

    Propanamide,2-methyl-;Isobutyramide;2-Methylpropanamide;Isobutyrimidic acid;Isopropylformamide;Isobutanamide;2-Methylpropionamide;VX 366;NSC 8423

  • Categories:

    Organic Chemistry  >  Amides

Description

white needle-like crystalline powder

Isobutyramide Basic Attributes

87.12

87.12

209-265-9

82UOE7B38Z

8423

DTXSID1060340

2924199090

Characteristics

43.1

0.2

white needle-like crystalline powder

0.9±0.1 g/cm3

128 °C

218 °C

216-220°C

1.418

soluble in water.

Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.

Safety Information

NONH for all modes of transport

3

22

24/25

TX1475000

Xn

Stable under normal temperatures and pressures.

P264, P270, P301+P312, P330, P501

H302

|Warning|H302 (95.12%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 42 companies from 3 notifications to the ECHA C&L Inventory.

Drug Information

Substances that inhibit or prevent the proliferation of NEOPLASMS. (See all compounds classified as Antineoplastic Agents.)

isobutyramide

Isobutyramide Use and Manufacturing

Methods of Manufacturing

After isobutyric acid is chlorinated to obtain isobutyryl chloride, it is obtained by amidation. Add isobutyryl chloride dropwise to concentrated ammonia water under vigorous stirring, and control the feeding speed so that the temperature does not exceed 15°C. After the addition was completed, the mixture was stirred for 1 h, and the mixture was evaporated to dryness under reduced pressure. The residue was isobutyramide and ammonium chloride. Ethyl acetate was added to the residue, boiled for 10 minutes, filtered, and vacuum dried to obtain the finished product.

Uses

Used in organic synthesis, preparation of isobutyronitrile, etc.

Propanamide, 2-methyl-: ACTIVE

Computed Properties

Molecular Weight:87.12
XLogP3:0.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:87.068413911
Monoisotopic Mass:87.068413911
Topological Polar Surface Area:43.1
Heavy Atom Count:6
Complexity:58.6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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