2-(Bromomethyl)-4-phenyl-1,3-thiazole

HCID 53482102

Notes Reactions

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Basic information

CAS: 78502-79-1
Standard SMILES: BrCc1nc(-c2ccccc2)cs1
InChIKey: MYRGZTAFPPWJGI-UHFFFAOYSA-N
Molecular formula: C10H8BrNS
Average molar mass: 254.15 g/mol
Monoisotopic mass: 252.95608

Names & identifiers

Preferred name: 2-(Bromomethyl)-4-phenyl-1,3-thiazole
IUPAC: 2-(bromomethyl)-4-phenyl-1,3-thiazole
English name: 2-(bromomethyl)-4-phenylthiazole
Molecular formula: C10H8BrNS
Molecular weight: 254.15

Names & synonyms

78502-79-12-(BROMOMETHYL)-4-PHENYL-1,3-THIAZOLEDTXSID50703877RefChem:253349DTXCID206546252-(bromomethyl)-4-phenylthiazole2-Bromomethyl-4-phenylthiazoleMFCD12405586SCHEMBL15348483MYRGZTAFPPWJGI-UHFFFAOYSA-N2-(bromomethyl)-4-phenyl-thiazoleAKOS016005782

Show more names

Thiazole, 2-(bromomethyl)-4-phenyl-DS-16933DB-031906O105062-Bromomethyl-4-phenylthiazole, 97% (H51780)F231342

Database identifiers

CAS: 78502-79-1
PubChem CID: 53482102
DTXSID: DTXSID50703877
EC Number: 679-309-3

Properties

Computed structural properties

XLogP: 3.2
Topological polar surface area: 41.1 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 2
Heavy atoms: 13
Formal charge: 0
Complexity: 159

Physicochemical properties

storage temp.: 2 · under inert gas (nitrogen or Argon) at 2-8°C
CAS DataBase Reference: 78502 · 78502-79-1
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H332-H335
Precautionary statements: 261 · P261-P280-P305+P351+P338

Safety & regulation

GHS classification

GHS Classification · 5 items

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 4 reports by companies from 1 notifications to the ECHA C&L Inventory.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.