Basic information
- CAS
2246-46-0- Standard SMILES
Oc1ccc(N=Nc2nccs2)c(O)c1- InChIKey
SHNIKUXMZFPPCS-UHFFFAOYSA-N- Molecular formula
- C9H7N3O2S
- Average molar mass
- 221.24 g/mol
- Monoisotopic mass
- 221.02589765
Names & identifiers
- Preferred name
- 4-(2'-Thiazolylazo)resorcinol
- IUPAC
- 4-(1,3-thiazol-2-yldiazenyl)benzene-1,3-diol
- English name
- 4-(2-Thiazolylazo)resorcinol
- Molecular formula
- C9H7N3O2S
- Molecular weight
- 221.24
Names & synonyms
2246-46-04-(Thiazol-2-ylazo)resorcinol4-(2'-Thiazolylazo)resorcinolDTXSID701307456RefChem:510580DTXCID101333192218-836-14-(2-Thiazolylazo)resorcinol4-(Thiazol-2-yldiazenyl)benzene-1,3-diol1,3-Benzenediol, 4-(2-thiazolylazo)-4-(1,3-thiazol-2-yldiazenyl)benzene-1,3-diolMFCD00005322
Show more names
TAR3-Benzenediol,4-(2-thiazolylazo)-1NSC 298197Thiazole azobenzene4-(2-THIAZOYLAZO)RESORCINOL4-(Thiazol-2-ylazo)resorcin4-(Thiazole-2-ylazo)resorcinol4-(2-thiazolylazo)-3-benzenediol
MLS000757077CHEMBL4296835(E)-4-(thiazol-2-yldiazenyl)benzene-1,3-diolNSC-29819796627-60-04-[(1E)-2-(1,3-thiazol-2-yl)diazen-1-yl]benzene-1,3-diolEINECS 218-836-1NSC298197
Database identifiers
- CAS
2246-46-0、96627-60-0- PubChem CID
- 75253
- DTXSID
DTXSID701307456- ChEMBL
CHEMBL1433124、CHEMBL4296835- UNII
- XM6NV2GYM9
- EC Number
- 218-836-1
- Nikkaji
- J207.978J
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 106 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 239
Physicochemical properties
- Melting point
- 211 °C · 211 °C (dec.)(lit.)
- Boiling point
- 434.5 · 434.5±38.0 °C(Predicted)
- Density
- 1.53 · 1.53±0.1 g/cm3(Predicted)
- solubility
- 50 vol% · almost transparency in hot EtOH50vol%
- form
- powder to crystal
- pka
- 7.99 · 7.99±0.35(Predicted)
- color
- Light yellow to Brown
- Thermal Conductivity
- 0.19 W/ · 0.19 W/(m·K)
- BRN
- 204257 · 204257
- Dielectric constant
- 4 · 4.0(Ambient)
- CAS DataBase Reference
- 2246 · 2246-46-0(CAS DataBase Reference)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 264 · P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P280a-P304+P340-P405-P501a-P261-P305+P351+P338
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36
- WGK Germany
- 3 · 3
- HS Code
- 2934.1 · 2934.10.2000
Safety & regulation
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 44 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- wgk
- 3
- hs_code
- 2934.10.2000
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P280a-P304+P340-P405-P501a-P261-P305+P351+P338
Chemistry & industry
Applications
DescriptionA dark, viscous,usually pungent substance, tar is derived from the destructive distillation of various organic compounds such as wood,coal, or shale,that is used for various industrial purposes.
Uses4-(2-Thiazolylazo)resorcinol is used in treatment of psoriasis.
Suppliers43 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
阿诺西（上海）生物技术有限公司400-1107768 15058188853 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
上海腾准生物科技有限公司19821570922 · [email protected]
爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
Syntechem Co.,Ltd[email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
上海泰坦科技股份有限公司400-6009262 15618770481 · [email protected]
郑州研德生物科技有限公司0371-63682289 15538176268 · [email protected]
四川库利南科技有限公司400-1166-196 18981987031 · [email protected]
艾科试剂4008-755-333 18080918076 · [email protected]
上海思域化工科技有限公司86-21-34053660 · [email protected]
上海遐瑞医药科技有限公司+86 21 61551611
TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
TCI Europe320-37350700 · [email protected]
上海将来实业股份有限公司400-0066400 13621662912 · [email protected]
上海鑫圭生物科技有限公司15121041756 · [email protected]
河南东元化工科技有限公司16696119288 · [email protected]
珠海安哲生物科技有限公司13169972583 · [email protected]
九鼎化学（上海）科技有限公司4009209199 · [email protected]
广州和为医药科技有限公司17612033329 17612033329
上海源叶生物科技有限公司13636370518 · [email protected]
山东西亚化学有限公司4009903999 13395398332 · [email protected]
湖北诺纳科技有限公司59209883 17386169806 · [email protected]
Shanghai Daken Advanced Materials Co.,Ltd+86-2158073036 · [email protected]
上海臻励生物科技有限公司021-16621358918; 18516310516;16621358918;13045646768 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 19370895928 · [email protected]
厦门盈融达化工有限公司+86-0592-6210733 · [email protected]
TCI Chemicals (India) Pvt. Ltd.[email protected]
海蔚化学86-21-51086038 · [email protected]
Aladdin Scientific[email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
郑州安慕斯化工产品有限公司15981811963 18737195735 · [email protected]
湖北诺纳科技有限公司027-59209883 17386138556 · [email protected]
河南威梯希化工科技有限公司0371-55135753 18003832934 · [email protected]
凌源贝卞森生物科技有限公司18642120371 · [email protected]
Related reactions
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No reaction records under the current filter.
Compound notes
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