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Bromoacetanilide

Bromoacetanilide structure

CAS No:
103-88-8
Formula:
C8H8BrNO
Chemical Name:
Bromoacetanilide
Synonyms:
Acetamide,N-(4-bromophenyl)-;Acetanilide,4′-bromo-;Acetanilide,p-bromo-;N-(4-Bromophenyl)acetamide;Antisepsin;Asepsin;p-Bromoacetanilide;p-Bromo-N-acetanilide;Bromoantifebrin;1-Bromo-4-acetamidobenzene;4′-Bromoacetanilide;N-Acetyl-p-bromoaniline;N-(p-Bromophenyl)acetamide;1-(N-Acetylamino)-4-bromobenzene;N-Acetyl-4-bromoaniline;Monobromoacetanilide;Bromoacetanilide;NSC 105442;NSC 8048;4-Acetamido-1-bromobenzene;4-(Acetylamino)-1-bromobenzene
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

Description

White to light beige crystalline solidreparation of 4'-Bromoacetanilide from Acetanilide. Principle: Aromatic compounds can be conveniently brominated by the use of brominating agent, which is normally a solution of bromine in acetic acid. Bromination of activated aromatic compounds usually give 2, 4, 6-tribromo derivatives while moderately activating group like anilide give preferably the para bromo product.

Bromoacetanilide Basic Attributes

Molecular Weight：

214.06

Exact Mass：

214.06

EC Number：

203-154-9

UNII：

4KB44F25A3

NSC Number：

105442|8048

DSSTox ID：

DTXSID6059283

HScode：

29242998

Characteristics

PSA：

29.1

XLogP3：

2.3

Density：

1.72

Melting Point：

168 °C

Boiling Point：

353.4°C (estimate)

Flash Point：

167.6±23.2 °C

Refractive Index：

1.6120 (estimate)

Water Solubility：

alcohol: moderately soluble

Safety Information

Packing level：

III

Hazard category：

6.1(b)

Transport codes：

2811

wgk germany：

hazard class code：

R36/37/38

safety instructions：

26-36

RTECS Number：

AD9625000

Marks：

Stability/Shelf Life：

Stable. Incompatible with strong oxidizing agents.

Precautionary statement(s)：

P261-P305 + P351 + P338

Hazard Statements：

H315-H319-H335

GHS Classification：

|Warning|H315 (97.92%): 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 48 companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Toxicity

Mobility：

89.13 L/kg

Bromoacetanilide Use and Manufacturing

Manufacturing Info：

Acetamide, N-(4-bromophenyl)-: ACTIVE

Computed Properties

Molecular Weight:214.06
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:212.97893
Monoisotopic Mass:212.97893
Topological Polar Surface Area:29.1
Heavy Atom Count:11
Complexity:141
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Material

Sodium bicarbonate

Acetic acid

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