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3,4-Dichlorophenyl isothiocyanate

Also known as: 1,2-dichloro-4-isothiocyanatobenzene, Benzene, 1,2-dichloro-4-isothiocyanato-, Isothiocyanic acid, 3,4-dichlorophenyl ester, 1,2-Dichloro-4-isothiocyanatobenzene, 3,4-Dichlorophenylisothiocyanate

3,4-Dichlorophenyl isothiocyanate (CAS 6590-94-9) is a compound in the Organic Acids category listed in the Jingsj chemical database. It has the molecular formula C7H3Cl2NS and a molecular weight of 204.07600 g/mol. Key properties include a boiling point of 134-136 °C7 mm Hg(lit.), a density of 1.422 g/mL at 25 °C(lit.) and a flash point of >110.0 °C. It is classified under GHS with signal word Danger and hazard statements H314 — Causes severe skin burns and eye damage. No supplier offers are currently listed; request a quote. Record last updated Nov 3, 2026.

CAS No.
6590-94-9
Jingsj CID
J-44612-8
Molecular Formula
C7H3Cl2NS
Molecular Weight
204.07600 g/mol
Category
Organic Acids
Last updated
11/3/2026

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Physicochemical Properties

Boiling Point134-136 °C7 mm Hg(lit.)
Density1.422 g/mL at 25 °C(lit.)
Flash Point>110.0 °C
Exact Mass202.93600
PSA44.45000
LogP3.72770
Refractive Indexn20/D 1.68(lit.)

GHS Safety & Compliance

CorrosionSignal word: Danger
  • H314 — Causes severe skin burns and eye damage

Customs & Trade Information

HS Code2930909090
Summary2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

Frequently Asked Questions

What is the CAS number of 3,4-Dichlorophenyl isothiocyanate?

The CAS number of 3,4-Dichlorophenyl isothiocyanate is 6590-94-9.

What are the molecular formula and molecular weight of 3,4-Dichlorophenyl isothiocyanate?

3,4-Dichlorophenyl isothiocyanate has molecular formula C7H3Cl2NS and molecular weight 204.07600 g/mol.

Is 3,4-Dichlorophenyl isothiocyanate hazardous?

3,4-Dichlorophenyl isothiocyanate has GHS signal word Danger and hazard statements H314 — Causes severe skin burns and eye damage.

What are the upstream and downstream products of 3,4-Dichlorophenyl isothiocyanate?

For 3,4-Dichlorophenyl isothiocyanate, Upstream Products: Thiophosgene, 3,4-Dichloroaniline, Carbon disulphide; Downstream Products: 1-(3,4-Dichlorophenyl)-2-thiourea, 2-Thiazolamine, N-(3,4-dichlorophenyl)-4,5-dihydro-, 1-(3,4-Dichlorophenyl)-1,2-dihydro-5H-tetrazole-5-thione.

Data compiled from public chemical databases such as PubChem and supplier catalogs; supplier offers are provided by suppliers.

Last updated:

How to cite: Jingsj. "3,4-Dichlorophenyl isothiocyanate (CAS 6590-94-9)". Jingsj Chemical Database. https://www.jingsj.com/compound/J-44612-8 (accessed 2026-11-09).

Data for reference only; verify product details with suppliers before purchase.