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5,7-Dichloroisatin

5,7-Dichloroisatin structure

CAS No:
6374-92-1
Formula:
C8H3Cl2NO2
Chemical Name:
5,7-Dichloroisatin
Synonyms:
1H-Indole-2,3-dione,5,7-dichloro-;Indole-2,3-dione,5,7-dichloro-;Isatin,5,7-dichloro-;5,7-Dichloro-1H-indole-2,3-dione;5,7-Dichloroisatin;NSC 26045
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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5,7-Dichloroisatin Basic Attributes

Molecular Weight：

216.021

Exact Mass：

216.02

EC Number：

228-928-3

NSC Number：

26045

DSSTox ID：

DTXSID30213181

HScode：

2933990090

Characteristics

PSA：

46.17000

XLogP3：

1.67

Appearance：

YELLOW TO GOLD TO TAN POWDER, CRYSTALS

Density：

1.6±0.1 g/cm3

Melting Point：

313 °C @ Solvent: Acetic acid

Refractive Index：

1.638

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

R22;R41

safety instructions：

S37/39

Marks：

Xn: Harmful;

Precautionary statement(s)：

P280-P305 + P351 + P338

Hazard Statements：

H302-H318

GHS Classification：

|Danger|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P280, P301+P312, P305+P351+P338, P310, P330, and P501|Aggregated GHS information provided by 39 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:216.02
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Exact Mass:214.9540837
Monoisotopic Mass:214.9540837
Topological Polar Surface Area:46.2
Heavy Atom Count:13
Complexity:269
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes