Basic information
- CAS
1138444-37-7- Standard SMILES
CCOC(=O)c1sc(-c2ccccn2)nc1CBr- InChIKey
RNJKUHUGSBTCRJ-UHFFFAOYSA-N- Molecular formula
- C12H11BrN2O2S
- Average molar mass
- 327.2 g/mol
- Monoisotopic mass
- 325.97246
Names & identifiers
- Preferred name
- Ethyl 4-(bromomethyl)-2-(pyridin-2-yl)-1,3-thiazole-5-carboxylate
- IUPAC
- ethyl 4-(bromomethyl)-2-pyridin-2-yl-1,3-thiazole-5-carboxylate
- English name
- Ethyl 2-(2-pyridyl)-4-(bromomethyl)-thiazole-5-carboxylate
- Molecular formula
- C12H11BrN2O2S
- Molecular weight
- 327.19694
Names & synonyms
1138444-37-7ethyl 4-(bromomethyl)-2-(pyridin-2-yl)-1,3-thiazole-5-carboxylateDTXSID90673883RefChem:343750DTXCID30624632Ethyl 2-(2-pyridyl)-4-(bromomethyl)-thiazole-5-carboxylateethyl 4-bromomethyl-2-(2-pyridyl)thiazole-5-carboxylateethyl-2-(2-pyridyl)-4-(bromomethyl)-Thiazole-5-CarboxylateMFCD11869291ethyl 4-(bromomethyl)-2-pyridin-2-yl-1,3-thiazole-5-carboxylate5-Thiazolecarboxylic acid, 4-(bromomethyl)-2-(2-pyridinyl)-, ethyl esterEthyl 4-(bromomethyl)-2-(pyridin-2-yl)thiazole-5-carboxylate
Show more names
RNJKUHUGSBTCRJ-UHFFFAOYSA-NAKOS015854330HY-W329522PD021323DB-265048CS-0441043F097834Ethyl 2(2-pyridyl)-4-(bromomethyl)thiazole-5-carboxylate
Database identifiers
- CAS
1138444-37-7- PubChem CID
- 46736799
- DTXSID
DTXSID90673883- EC Number
- 679-123-2
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 80.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 293
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- HazardClass
- IRRITANT
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (90.7%): 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 43 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (90.7%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_class
- IRRITANT
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Suppliers13 total
Aladdin Scientific[email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
MedBio脉铂医药021-69568360 18916172912 · [email protected]
天津狄克特科技有限公司22-58627059 13920586291 · [email protected]
泰州市众致生物科技有限公司[email protected] 15066129350 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
山东小野化学股份有限公司0539-6362799 20）
上海宏叶生物科技有限公司400-9205774 400-920-5774 · [email protected]
ChemeGen 中国18818260767 · [email protected]
济南思考化学有限公司0531-0000 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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