ChemicalBook > CAS DataBase List > 4-Chlorophenyl isocyanate

4-Chlorophenyl isocyanate

Product Name
4-Chlorophenyl isocyanate
CAS No.
104-12-1
Chemical Name
4-Chlorophenyl isocyanate
Synonyms
1-Chloro-4-isocyanatobenzene;P-CHLOROPHENYL ISOCYANATE;PCPI;4-Chlorphenylisocyanate;PARA CHLOROPHENYL ISOCYANATE;pcic;4-Chlorophenyl isocy;p-Chlorfenylisokyanat;4-Chlorphenylisocyanat;chlorophenylisocyanate
CBNumber
CB6680525
Molecular Formula
C7H4ClNO
Formula Weight
153.57
MOL File
104-12-1.mol
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4-Chlorophenyl isocyanate Property

Melting point:
26-29 °C (lit.)
Boiling point:
203-204 °C (lit.)
Density 
1.2 g/mL at 25 °C (lit.)
vapor pressure 
30Pa at 20℃
refractive index 
n20/D 1.5618(lit.)
Flash point:
>230 °F
storage temp. 
2-8°C
solubility 
Chloroform (Slightly)
form 
Crystalline Solid
color 
White to yellow
Odor
sharp irritating odor
Water Solubility 
DECOMPOSES
Sensitive 
Moisture Sensitive/Lachrymatory
BRN 
386235
LogP
3.12 at 22℃
CAS DataBase Reference
104-12-1(CAS DataBase Reference)
NIST Chemistry Reference
Benzene, 1-chloro-4-isocyanato-(104-12-1)
EPA Substance Registry System
p-Chlorophenyl isocyanate (104-12-1)
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Safety

Hazard Codes 
T+,T,C
Risk Statements 
25-26-37/38-41-42-52/53
Safety Statements 
23-26-28-36/37/39-45-61-38-37/39-28A-22
RIDADR 
UN 2811 6.1/PG 2
WGK Germany 
3
RTECS 
NQ8575000
10-19-21
Hazard Note 
Toxic/Corrosive/Lachrymatory/Moisture Sensitive
TSCA 
Yes
HazardClass 
6.1
PackingGroup 
II
HS Code 
29291090
Hazardous Substances Data
104-12-1(Hazardous Substances Data)
Toxicity
mammal (species unspecified),LC50,inhalation,53mg/m3 (53mg/m3),Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 11(4), Pg. 23, 1967.
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Danger
Hazard statements

H301Toxic if swalloed

H315Causes skin irritation

H318Causes serious eye damage

H330Fatal if inhaled

H334May cause allergy or asthma symptoms or breathing difficulties if inhaled

H335May cause respiratory irritation

H410Very toxic to aquatic life with long lasting effects

Precautionary statements

P260Do not breathe dust/fume/gas/mist/vapours/spray.

P273Avoid release to the environment.

P280Wear protective gloves/protective clothing/eye protection/face protection.

P302+P352IF ON SKIN: wash with plenty of soap and water.

P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

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N-Bromosuccinimide Price

Sigma-Aldrich
Product number
152277
Product name
4-Chlorophenyl isocyanate
Purity
98%
Packaging
5g
Price
$54.2
Updated
2024/03/01
Sigma-Aldrich
Product number
152277
Product name
4-Chlorophenyl isocyanate
Purity
98%
Packaging
100g
Price
$116
Updated
2024/03/01
Alfa Aesar
Product number
A14966
Product name
4-Chlorophenyl isocyanate, 98%
Packaging
5g
Price
$21.65
Updated
2024/03/01
Alfa Aesar
Product number
A14966
Product name
4-Chlorophenyl isocyanate, 98%
Packaging
25g
Price
$41.65
Updated
2024/03/01
Alfa Aesar
Product number
A14966
Product name
4-Chlorophenyl isocyanate, 98%
Packaging
100g
Price
$104.65
Updated
2024/03/01
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4-Chlorophenyl isocyanate Chemical Properties,Usage,Production

Chemical Properties

white to yellow crystalline solid

Uses

4-Chlorophenyl isocyanate is used in the preparation of isothiocyanates. Aryl isocyanates undergo [2+2] cycloaddition reactions with dihydrofuran to give bicyclic ?-lactams in high yield.

Uses

4-Chlorophenyl isocyanate was used in the preparation of isothiocyanates.

Synthesis Reference(s)

The Journal of Organic Chemistry, 34, p. 3200, 1969 DOI: 10.1021/jo01262a089

General Description

Colorless to yellow liquid or crystals. Used as an intermediate in pesticide and pharmaceutical manufacture.

Reactivity Profile

Isocyanates and thioisocyanates are incompatible with many classes of compounds, reacting exothermically to release toxic gases. Reactions with amines, aldehydes, alcohols, alkali metals, ketones, mercaptans, strong oxidizers, hydrides, phenols, and peroxides can cause vigorous releases of heat. Acids and bases initiate polymerization reactions in these materials. Some isocyanates react with water to form amines and liberate carbon dioxide. Base-catalysed reactions of isocyanates with alcohols should be carried out in inert solvents. Such reactions in the absence of solvents often occur with explosive violence, [Wischmeyer(1969)].

Safety Profile

Poison by ingestion and inhalation. Unspecified human systemic effects. A severe eye and moderate skin irritant. A flammable liquid when exposed to heat or flame. Dangerous, can explode on distillation. When heated to decomposition it emits toxic fumes of Cl-, CN-, and NOx.

Purification Methods

Purify the isocyanate by recrystallisation from pet ether (b 30-40o) or better by fractional distillation. TOXIC irritant. [Beilstein 12 H 616, 12 III 1376, 12 IV 1213.]

4-Chlorophenyl isocyanate Preparation Products And Raw materials

Raw materials

Preparation Products

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4-Chlorophenyl isocyanate Suppliers

J & K SCIENTIFIC LTD.
Tel
010-82848833 400-666-7788
Fax
86-10-82849933
Email
jkinfo@jkchemical.com
Country
China
ProdList
96815
Advantage
76
Meryer (Shanghai) Chemical Technology Co., Ltd.
Tel
4006608290; 18621169109
Fax
86-21-61259102
Email
market03@meryer.com
Country
China
ProdList
40241
Advantage
62
Alfa Aesar
Tel
400-6106006
Fax
021-67582001/03/05
Email
saleschina@alfa-asia.com
Country
China
ProdList
30132
Advantage
84
TCI (Shanghai) Development Co., Ltd.
Tel
021-67121386
Fax
021-67121385
Email
Sales-CN@TCIchemicals.com
Country
China
ProdList
24539
Advantage
81
Energy Chemical
Tel
021-021-58432009 400-005-6266
Fax
021-58436166
Email
sales8178@energy-chemical.com
Country
China
ProdList
44751
Advantage
61
Beijing Ouhe Technology Co., Ltd
Tel
010-82967028 13552068683
Fax
+86-10-82967029
Email
2355560935@qq.com
Country
China
ProdList
12426
Advantage
60
JinYan Chemicals(ShangHai) Co.,Ltd.
Tel
13817811078
Fax
86-021-50426522,50426273
Email
sales@jingyan-chemical.com
Country
China
ProdList
9984
Advantage
60
Pure Chemistry Scientific Inc.
Tel
001-857-928-2050 or 1-888-588-9418
Fax
001-617-206-9595
Email
sales@chemreagents.com
Country
United States
ProdList
10194
Advantage
62
Accela ChemBio Co.,Ltd.
Tel
021-50795510 4000665055
Fax
021-50795055
Email
sales@accelachem.com
Country
China
ProdList
11660
Advantage
64
Wuhan Wei Shunda Technology Development Co., Ltd.
Tel
86-027-88774375
Fax
86-027-88416321
Email
mwmwhot@163.com
Country
China
ProdList
233
Advantage
65
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View Lastest Price from 4-Chlorophenyl isocyanate manufacturers

Ouhuang Engineering Materials (Hubei) Co., Ltd
Product
4-Chlorophenyl isocyanate 104-12-1
Price
US $10.00/kg
Min. Order
1kg
Purity
99.6%
Supply Ability
100000
Release date
2024-04-23
Hebei Duling International Trade Co. LTD
Product
4-Chlorophenyl isocyanate 104-12-1
Price
US $100.00/kg
Min. Order
1kg
Purity
99%
Supply Ability
100 tons
Release date
2023-05-25
Henan Bao Enluo International TradeCo.,LTD
Product
4-Chlorophenyl isocyanate 104-12-1
Price
US $10.00/kg
Min. Order
1kg
Purity
99%
Supply Ability
1000tons
Release date
2023-08-17

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