Cas no 2392-68-9 (3-Chlorophenyl isothiocyanate)
3-Chlorophenyl isothiocyanate structure
Product Name:3-Chlorophenyl isothiocyanate
CAS No:2392-68-9
MF:C7H4ClNS
MW:169.631359100342
MDL:MFCD00004805
CID:84288
PubChem ID:75449
Update Time:2025-04-18
3-Chlorophenyl isothiocyanate Chemical and Physical Properties
Names and Identifiers
-
- 3-Chlorophenyl isothiocyanate
- 3-Chloroisothiocyanatobenzene
- 1-chloro-3-isothiocyanatobenzene
- 1-chloro-3-isothiocyanato-benzene
- Benzene,1-chloro-3-isothiocyanato
- Isothiocyanic acid,3-chlorophenyl ester
- Isothiocyanic acid,m-chlorophenyl ester
- m-chlorophenyl isothiocyanate
- Isothiocyanic acid, m-chlorophenyl ester
- Benzene,1-chloro-3-isothiocyanato-
- WLN: SCNR CG
- Z56926571
- AKOS000212296
- SY012193
- 3-chloro phenyl isothiocyanate
- MFCD00004805
- 9-METHYL-PHENAZINE-1-CARBOXYLICACID
- 1-Chloro-3-isothiocyanatobenzene #
- BP-12935
- 2392-68-9
- NSC132371
- H11337
- 1-chloranyl-3-isothiocyanato-benzene
- 3-Chlorophenylisothiocyanate
- BRN 0636856
- WGXCKFMVBAOIFH-UHFFFAOYSA-
- J-802113
- NSC-132371
- Benzene, 1-chloro-3-isothiocyanato-
- F2121-0329
- EN300-17416
- A816991
- LS-13248
- 3-Chlorophenyl isothiocyanate, 98%
- FT-0615509
- SCHEMBL180843
- NSC 132371
- InChI=1/C7H4ClNS/c8-6-2-1-3-7(4-6)9-5-10/h1-4H
- DTXSID20178634
- Isothiocyanic acid, 3-chlorophenyl ester
- 3-12-00-01317 (Beilstein Handbook Reference)
-
- MDL： MFCD00004805
- Inchi： 1S/C7H4ClNS/c8-6-2-1-3-7(4-6)9-5-10/h1-4H
- InChI Key： WGXCKFMVBAOIFH-UHFFFAOYSA-N
- SMILES： ClC1=CC=CC(=C1)N=C=S
- BRN： 636856
Computed Properties
- Exact Mass: 168.97500
- Monoisotopic Mass: 168.975
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 10
- Rotatable Bond Count: 1
- Complexity: 154
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: nothing
- Topological Polar Surface Area: 44.4A^2
Experimental Properties
- Color/Form: Irritating yellow liquid
- Density: 1.292?g/mL?at 25?°C(lit.)
- Boiling Point: 249-250?°C(lit.)
- Flash Point: Degrees Fahrenheit:235.4°F
Degrees Celsius:113°C - Refractive Index: n20/D 1.6585(lit.)
- PSA: 44.45000
- LogP: 3.07430
- Sensitiveness: Moisture Sensitive
- Solubility: Hydrolyzable
3-Chlorophenyl isothiocyanate Security Information
-
Symbol:
- Signal Word：Warning
- Hazard Statement： H302+H312+H332,H315,H319,H335
- Warning Statement： P261,P280,P305+P351+P338
- Hazardous Material transportation number：2810
- WGK Germany：3
- Hazard Category Code： 20/21/22-36/37/38
- Safety Instruction： S45-S36/37/39-S26-S37/39
- RTECS：NX8474500
-
Hazardous Material Identification：
- HazardClass：8
- PackingGroup：III
- Risk Phrases：R23/24/25; R36/37/38
- Packing Group：III
- Safety Term：8
- Packing Group：III
- Hazard Level：8
3-Chlorophenyl isothiocyanate Customs Data
- HS CODE：2930909090
- Customs Data：
China Customs Code:
2930909090Overview:
2930909090. Other organic sulfur compounds. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:30.0%
Declaration elements:
Product Name, component content, use to
Summary:
2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%
3-Chlorophenyl isothiocyanate Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | A-SC594-1g |
3-Chlorophenyl isothiocyanate |
2392-68-9 | 97% | 1g |
￥91.0 | 2022-06-10 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | A-SC594-5g |
3-Chlorophenyl isothiocyanate |
2392-68-9 | 97% | 5g |
￥261.0 | 2022-06-10 | |
| XI GE MA AO DE LI QI （ SHANG HAI ） MAO YI Co., Ltd. | 253766-5G |
3-Chlorophenyl isothiocyanate |
2392-68-9 | 98% | 5G |
￥383.58 | 2022-02-24 | |
| SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd. | C856319-100g |
3-Chlorophenylisothiocyanate |
2392-68-9 | 95% | 100g |
￥1,878.00 | 2022-09-02 | |
| TRC | C993683-500mg |
3-Chlorophenyl isothiocyanate |
2392-68-9 | 500mg |
$ 50.00 | 2022-06-06 | ||
| TRC | C993683-1g |
3-Chlorophenyl isothiocyanate |
2392-68-9 | 1g |
$ 65.00 | 2022-06-06 | ||
| TRC | C993683-5g |
3-Chlorophenyl isothiocyanate |
2392-68-9 | 5g |
$ 115.00 | 2022-06-06 | ||
| SHANG HAI YI EN HUA XUE JI SHU Co., Ltd. | R029501-100g |
3-Chlorophenyl isothiocyanate |
2392-68-9 | 98% | 100g |
￥2324 | 2024-05-24 | |
| SHANG HAI YI EN HUA XUE JI SHU Co., Ltd. | R029501-25g |
3-Chlorophenyl isothiocyanate |
2392-68-9 | 98% | 25g |
￥679 | 2024-05-24 | |
| SHANG HAI YI EN HUA XUE JI SHU Co., Ltd. | R029501-5g |
3-Chlorophenyl isothiocyanate |
2392-68-9 | 98% | 5g |
￥209 | 2024-05-24 |
3-Chlorophenyl isothiocyanate Related Literature
-
Arghya Basu,Gopal Das Dalton Trans. 2012 41 10792
-
Bernard Pirotte,Xavier Florence,Eric Goffin,Philippe Lebrun Med. Chem. Commun. 2019 10 431
Related Categories
- Solvents and Organic Chemicals Organic Compounds Benzenoids Benzene and substituted derivatives Chlorobenzenes
- Solvents and Organic Chemicals Organic Compounds Benzenoids Benzene and substituted derivatives Halobenzenes Chlorobenzenes
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- Solvents and Organic Chemicals Organic Compounds Acids/Esters
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