ChemicalBook > CAS DataBase List > 3-NITROPHENYL ISOTHIOCYANATE

3-NITROPHENYL ISOTHIOCYANATE

Product Name: 3-NITROPHENYL ISOTHIOCYANATE
CAS No.: 3529-82-6
Chemical Name: 3-NITROPHENYL ISOTHIOCYANATE
Synonyms: 3-NitrophenyL;3-NITROPHENYL ISOTHIOCYANATE;M-NITROPHENYL ISOTHIOCYANATE;3-Nitrophenyl isothiocyate, 98%;1-isothiocyanato-3-nitrobenzene;1-isothiocyanato-3-nitro-benzen;3-Nitrophenyl isothiocyanate 98%;3-Nitrophenyl isothiocyanate-97%;Benzene, 1-isothiocyanato-3-nitro-;isothiocyanicacid,m-nitrophenylester
CBNumber: CB5235618
Molecular Formula: C7H4N2O2S
Formula Weight: 180.18
MOL File: 3529-82-6.mol

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3-NITROPHENYL ISOTHIOCYANATE Property

Melting point:: 57-60 °C(lit.)
Boiling point:: 277.5°C (rough estimate)
Density: 1.4360 (rough estimate)
refractive index: 1.6000 (estimate)
storage temp.: 2-8°C
Water Solubility: 50.45mg/L(25 ºC)
Sensitive: Moisture Sensitive
BRN: 2094061
InChI: InChI=1S/C7H4N2O2S/c10-9(11)7-3-1-2-6(4-7)8-5-12/h1-4H
InChIKey: OEZXLKSZOAWNJU-UHFFFAOYSA-N
SMILES: C1(N=C=S)=CC=CC([N+]([O-])=O)=C1
CAS DataBase Reference: 3529-82-6(CAS DataBase Reference)
EPA Substance Registry System: Benzene, 1-isothiocyanato-3-nitro- (3529-82-6)

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Safety

Hazard Codes: C
Risk Statements: 34
Safety Statements: 23-26-36/37/39-45
RIDADR: UN 3261 8/PG 3
WGK Germany: 3
RTECS: NX9110000
TSCA: Yes
HazardClass: 6.1
PackingGroup: II
HS Code: 29309090

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Hazard and Precautionary Statements (GHS)

Symbol(GHS)

Signal word

Danger

Hazard statements

H314Causes severe skin burns and eye damage

Precautionary statements

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

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

P303+P361+P353IF ON SKIN (or hair): Remove/Take off Immediately all contaminated clothing. Rinse SKIN with water/shower.

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

P363Wash contaminated clothing before reuse.

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N-Bromosuccinimide Price

Sigma-Aldrich

Product number: 487376
Product name: 3-Nitrophenyl isothiocyanate
Purity: 98%
Packaging: 10g
Price: $129.5
Updated: 2025/07/31

TCI Chemical

Product number: N1180
Product name: 1-Isothiocyanato-3-nitrobenzene
Purity: min. 98.0 %
Packaging: 5G
Price: $82
Updated: 2025/07/31

TCI Chemical

Product number: N1180
Product name: 1-Isothiocyanato-3-nitrobenzene
Purity: min. 98.0 %
Packaging: 25G
Price: $246
Updated: 2025/07/31

AK Scientific

Product number: 1355AE
Product name: 3-Nitrophenyl isothiocyanate
Packaging: 25g
Price: $351
Updated: 2021/12/16

SynQuest Laboratories

Product number: 8668-1-01
Product name: 3-Nitrophenyl isothiocyanate
Purity: 95%
Packaging: 25g
Price: $255
Updated: 2021/12/16

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3-NITROPHENYL ISOTHIOCYANATE Chemical Properties,Usage,Production

Uses

3-Nitrophenyl isothiocyanate may be used in the synthesis of 2-[(3-nitrophenyl)amino]naphtho[2,1-b]furo-5H-[3,2-d][1,3,4]thiadiazolo[3,2-a]pyrimidin- 5-one and 5-methyl-3-(3-nitrophenyl)-2-thiooxazolidin-4-one.
It may be used in the synthesis of the following thiourea derivatives:

N-[(3-chlorophenyl)methyl]-N′-(3-nitrophenyl)thiourea
N-[(5-chloro-2-methoxyphenyl)methyl]-N′-(3-nitrophenyl)thiourea
R/S-N-[6-chlorochroman-4-yl]-N′-(3-nitrophenyl)thiourea

General Description

3-Nitrophenyl isothiocyanate, also known as 1-isothiocyanato-3-nitrobenzene, is an organic building block containing an isocyanate group. Its enthalpy of vaporization at boiling point has been reported. Some of its physical properties like freezing point, boiling point, density and refractive index have been evaluated. Its synthesis from 3-nitroaniline has been reported.

3-NITROPHENYL ISOTHIOCYANATE Preparation Products And Raw materials

Raw materials

Preparation Products

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View Lastest Price from 3-NITROPHENYL ISOTHIOCYANATE manufacturers

Shaanxi Dideu Medichem Co. Ltd

Product: 3-Nitrophenyl isothiocyanate 3529-82-6
Price: US $0.00-0.00/KG
Min. Order: 10mg
Purity: 99%HPLC
Supply Ability: 2000tons
Release date: 2020-01-19

Career Henan Chemical Co

Product: 3-NITROPHENYL ISOTHIOCYANATE 3529-82-6
Price: US $1.00/KG
Min. Order: 1KG
Purity: 99%
Supply Ability: 10000KSG
Release date: 2020-01-02

3529-82-6, 3-NITROPHENYL ISOTHIOCYANATERelated Search:

1-isothiocyanato-3-nitro-benzen

1-isothiocyanato-3-nitrobenzene

isothiocyanicacid,m-nitrophenylester

3-Nitrophenyl isothiocyanate 98%

M-NITROPHENYL ISOTHIOCYANATE

3-NITROPHENYL ISOTHIOCYANATE

3-NitrophenyL

3-Nitrophenyl isothiocyate, 98%

Benzene, 1-isothiocyanato-3-nitro-

3-Nitrophenyl isothiocyanate-97%

3529-82-6

C7H4N202S

Thiocyanates/Isothiocyanates

Sulfur Compounds

Organic Building Blocks

Building Blocks

Organic Building Blocks

Sulfur Compounds

Thiocyanates/Isothiocyanates