4-Chlorophthalic anhydride

HCID 67044CAS 118-45-6

Basic information

Standard SMILES
O=C1OC(=O)c2cc(Cl)ccc21
InChIKey
BTTRMCQEPDPCPA-UHFFFAOYSA-N
Molecular formula
C8H3ClO3
Average molar mass
182.56 g/mol
Monoisotopic mass
181.97707164

Names & identifiers

Preferred name
4-Chlorophthalic anhydride
IUPAC
5-chloro-2-benzofuran-1,3-dione
English name
4-Chlorophthalic anhydride
Molecular formula
C8H3ClO3
Molecular weight
182.56

Names & synonyms

4-Chlorophthalic anhydride118-45-65-chloroisobenzofuran-1,3-dione5-Chloro-2-benzofuran-1,3-dione4-chlorophthalic acid anhydride1,3-Isobenzofurandione, 5-chloro-5-chlorophthalic anhydrideBPI93D0O61EINECS 204-251-9UNII-BPI93D0O61P-CHLOROPHTHALIC ANHYDRIDEDTXSID30151993
Show more names
CHLOROPHTHALIC ANHYDRIDE4-ChlorophthalicChlorophtalicanhydre,95%4-Chlorophtalic anhydride4-Chlorophthalic anhydridoroisobenzofuran-1,3-dioneChlorophthalicAnhydride,4-
EC 204-251-9PHTHALIC ANHYDRIDE, 4-CHLORO-RefChem:98612DTXCID9074484204-251-9BTTRMCQEPDPCPA-UHFFFAOYSA-NInChI=1/C8H3ClO3/c9-4-1-2-5-6(3-4)8(11)12-7(5)10/h1-3MFCD00152354

Database identifiers

CAS
118-45-6
PubChem CID
67044
DTXSID
DTXSID30151993
UNII
BPI93D0O61
EC Number
204-251-9
Nikkaji
J141.265E

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
43.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
0
Heavy atoms
12

Physicochemical properties

Melting point
96 °C · 96°C
Boiling point
290 °C · 290 °C
Density
1.594 · 1.594±0.06 g/cm3(Predicted)
vapor pressure
0.058 · 0.058-0.058Pa at 25℃
storage temp.
2 · under inert gas (nitrogen or Argon) at 2-8°C
solubility
soluble in Toluene

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H315 (57.1%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 7 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Regulatory Information · 3 items

Regulation (EC) No 1935/2004 (amended)

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Status: Cease Manufacture Update: 18-05-2017 https://echa.europa.eu/registration-dossier/-/registered-dossier/12546

Hazard Classes and CategoriesSkin Irrit. 2 (57.1%)

Safety data

tsca
TSCA listed
hs_code
2932990090
risk_code
36/37/38
Signal word
Danger
Symbol(GHS)
GHS05
safety_code
26-36/37/39

Chemistry & industry

Uses & manufacturing

General Manufacturing Information1,3-Isobenzofurandione, 5-chloro-: ACTIVE
Applications · 1 item

Uses4-chlorophthalic anhydride is an important monomer synthesis of polyimide and polyimide is considered to be the highest tolerance has been industrialized in the polymer and the shape and chemical stability of other materials can not like the outburst strength, wear resistance and extreme temperatures, excellent, has been widely used in aviation, aerospace, microelectronics and atom to the field of high technology. 4- of 4-chlorophthalic anhydride is mainly used in the synthesis of diphenyl ether dianhydride anhydride, two single and two double ether, thioether dianhydride anhydride two, two, and two amine polymerization ring was a series of polyimide engineering plastic with excellent performance. 4- of 4-chlorophthalic anhydride is not only the ideal raw material for the synthesis of various intermediates of polyimide, and can be used as a drug or pesticide.

Preparation methods · 1 item

PreparationA preparation method of 4-chlorophthalic anhydride uses monosodium phthalic acid as a raw material, uses water as a medium, uses a weak alkali solution as a pH regulator of a reaction system, and directly performs chlorination reaction with chlorine gas. The weak alkali solution is used as the pH regulator of the reaction system, which is beneficial to stabilizing the pH value of the reaction system, and can obtain high-yield 4-chlorophthalic acid monosodium coarse salt. The crude salt is desalted, dehydrated and closed to obtain a crude product of 4-chlorophthalic anhydride, which is purified by rectification to obtain high-purity 4-chlorophthalic anhydride.

Suppliers50 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
合肥翰刚医药科技有限公司+8618062405514 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]

Related reactions

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Linked notes

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