Basic information
- CAS
741670-62-2- Standard SMILES
c1nc(C2CCNCC2)cs1- InChIKey
BUMORARINGMZLH-UHFFFAOYSA-N- Molecular formula
- C8H12N2S
- Average molar mass
- 168.26 g/mol
Names & identifiers
- Preferred name
- 4-(1,3-Thiazol-4-yl)piperidine
- IUPAC
- 4-piperidin-4-yl-1,3-thiazole
- English name
- 4-(thiazol-4-yl)piperidine
- Molecular formula
- C8H12N2S
- Molecular weight
- 168.26
Names & synonyms
741670-62-24-(1,3-thiazol-4-yl)piperidineRefChem:510192816-936-54-(Piperidin-4-yl)thiazole4-piperidin-4-yl-1,3-thiazoleMFCD119345864-(4-piperidyl)thiazoleSCHEMBL1514862SCHEMBL28285144BUMORARINGMZLH-UHFFFAOYSA-NREB67062
Show more names
4-(thiazol-4-yl)piperidinePiperidine, 4-(4-thiazolyl)-
AKOS022257964SB42834DA-03164CS-0105916D76575EN300-138518Z1255428434
Database identifiers
- CAS
741670-62-2- PubChem CID
- 39236249
- EC Number
- 816-936-5
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 53.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 123
Physicochemical properties
- Boiling point
- 290.4 · 290.4±33.0 °C(Predicted)
- Density
- 1.126 · 1.126±0.06 g/cm3(Predicted)
- pka
- 9.85 · 9.85±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H315-H335
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
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 2 reports by companies from 1 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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319-H315-H335
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Suppliers5 total
海济医药科技（苏州）有限公司18012778619 · [email protected]
上海珂华生物科技有限公司021-60455363 18019463053 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
盐城希曼生物科技有限公司0515-88280676; 18921872653
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
Related reactions
2 records
Compound notes
Loading…