3,4-Dichlorophenyl isocyanate - ≥97% , CAS No.102-36-3

CAS: 102-36-3 Cat. No.: D102133 Formula: Cl2C6H3NCO Peso molecolare: 188.01 Beilstein Registry Number: 608325 Numero EC: 203-026-2
Disponibile su ordine
GRADE & PURITY ≥97%
Synonyms
DTXSID9033008 | Isocyanic Acid 3,4-Dichlorophenyl Ester | Tox21_200085 | 3.4-dichlorophenyl-isocyanate | Benzene, 1,2-dichloro-4-isocyanato- | BRN 0608325 | I0092 | 1,2-Dichloro-4-isocyanatobenzene # | BBL027368 | NCGC00090976-01 | 3,4-Dichlorphenyl isocy
Storage
Store at 2-8°C
Shipped In
Wet ice,FedEx DG Service
★
Size
Germania (EU)
USA*
Price
Qty
5g
D102133-5g
—
2 Disponibile
12,06€
25g
D102133-25g
—
2 Disponibile
19,00€
100g
D102133-100g
—
3 Disponibile
52,85€
500g
D102133-500g
—
3 Disponibile
132,68€
Enter a quantity for the sizes you want to add.
🧪

Why this grade

≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C Ships Wet ice,FedEx DG Service Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinonimi
DTXSID9033008 | Isocyanic Acid 3,4-Dichlorophenyl Ester | Tox21_200085 | 3.4-dichlorophenyl-isocyanate | Benzene, 1,2-dichloro-4-isocyanato- | BRN 0608325 | I0092 | 1,2-Dichloro-4-isocyanatobenzene # | BBL027368 | NCGC00090976-01 | 3,4-Dichlorphenyl isocy
Specifiche e purezza
≥97%
Condizioni di conservazione di stoccaggio
Store at 2-8°C
Spedito in
Wet ice,FedEx DG Service
Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.
Purezza
≥97%
Nomi e identificatori
Pubchem Sid508808647
Sorrisi canoniciC1=CC(=C(C=C1N=C=O)Cl)Cl
IUPAC Name1,2-dichloro-4-isocyanatobenzene
InChIKeyMFUVCHZWGSJKEQ-UHFFFAOYSA-N
INCHI1S/C7H3Cl2NO/c8-6-2-1-5(10-4-11)3-7(6)9/h1-3H
Isomeri SMILES C1=CC(=C(C=C1N=C=O)Cl)Cl
WGK Germania 2
RTECS NQ8760000
Numero UN 2250
Gruppo di imballaggio II
Peso molecolare 188.01
Beilstein 608325
Reaxy-Rn 608325
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=608325&ln=

Documentazione

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
ClasseBenzene and substituted derivatives
SubclassHalobenzenes
Intermediate Tree Nodes Chlorobenzenes
Direct ParentDichlorobenzenes
Alternative Parents Aryl chlorides  Isocyanates  Propargyl-type 1,3-dipolar organic compounds  Organopnictogen compounds  Organooxygen compounds  Organochlorides  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents 1,2-dichlorobenzene - Aryl chloride - Aryl halide - Isocyanate - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic homomonocyclic compound
DescrizioneThis compound belongs to the class of organic compounds known as dichlorobenzenes. These are compounds containing a benzene with exactly two chlorine atoms attached to it.
External Descriptors Not available
Struttura 3D
Modello di struttura chimica interattiva





Obiettivi associati (umani)
NR3C1 Tclin Glucocorticoid receptor (14987 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
RXRA Tclin Retinoid X receptor alpha (3637 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
AHR Tclin Aryl hydrocarbon receptor (1071 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
NR1H4 Tclin Bile acid receptor FXR (6228 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
TP53 Tchem Cellular tumor antigen p53 (48468 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Lymphoblastoid cell (5959 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
TDP1 Tchem Tyrosyl-DNA phosphodiesterase 1 (345557 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Obiettivi associati (non umani)
Cruzipain (33337 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Ppard Peroxisome proliferator-activated receptor delta (358 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mapk1 MAP kinase ERK2 (650 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
lef Anthrax lethal factor (7585 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Nfe2l2 Nuclear factor erythroid 2-related factor 2 (214 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Rorc Nuclear receptor ROR-gamma (89407 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Meccanismi d'azione
Certificati (CoA, COO, BSE/TSE e tabella di analisi)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

11 results found

Lot NumberCertificate TypeDataOggetto
H2628289Certificate of AnalysisSep 02, 2026 D102133
H2628290Certificate of AnalysisSep 02, 2026 D102133
C1827086Certificate of AnalysisAug 28, 2026 D102133
C1827088Certificate of AnalysisAug 13, 2026 D102133
I2321073Certificate of AnalysisJul 14, 2026 D102133
I2321075Certificate of AnalysisJul 14, 2026 D102133
I2321077Certificate of AnalysisJul 14, 2026 D102133
C1723013Certificate of AnalysisOct 17, 2025 D102133
A2509143Certificate of AnalysisJul 13, 2024 D102133
A2509144Certificate of AnalysisJul 13, 2024 D102133
A2509161Certificate of AnalysisJul 13, 2024 D102133

Show more ⌵

Proprietà chimiche e fisiche
SolubilitàSoluble in most organic solvents.
SensibilitàMoisture sensitive.
Punto di infiammabilità (°F)253.4 °F
Punto di infiammabilità (°C)123 °C
Punto di ebollizione (°C)118-120°C/18mmHg
Punto di fusione (°C)41-43°C
Peso molecolare188.010 g/mol
XLogP34.200
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass186.959 Da
Monoisotopic Mass186.959 Da
Topological Polar Surface Area29.400 Ų
Heavy Atom Count11
Formal Charge0
Complexity179.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Citations of This Product
Riferimenti
1. Xi Chen, Lijiaqi Zhang, Min Wu, Yong Huang.  (2022)  Preparing Hydrophobic Cellulose Nanofibers-SiO2 Films and Coating by One-Step Mechanochemical Method.  Polymers,  14  (20): (4413).  [PMID:36297992] [10.3390/polym14204413]
Calcolatori di soluzioni
Recensioni

Recensioni dei clienti

Shall we send you a message when we have discounts available?

Remind me later

Thank you! Please check your email inbox to confirm.

Oops! Notifications are disabled.