4-(Chloromethyl)-2-(thiophen-3-yl)-1,3-thiazole

HCID 602107
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Basic information

CAS
54747-64-7
Standard SMILES
ClCc1csc(-c2ccsc2)n1
InChIKey
APIQUDKCQIGCKQ-UHFFFAOYSA-N
Molecular formula
C8H6ClNS2
Average molar mass
215.7 g/mol

Names & identifiers

Preferred name
4-(Chloromethyl)-2-(thiophen-3-yl)-1,3-thiazole
IUPAC
4-(chloromethyl)-2-thiophen-3-yl-1,3-thiazole

Names & synonyms

4-(chloromethyl)-2-(thiophen-3-yl)-1,3-thiazoleRefChem:515572890-963-054747-64-74-(Chloromethyl)-2-(thiophen-3-yl)thiazole4-(chloromethyl)-2-thiophen-3-yl-1,3-thiazoleSCHEMBL4432636ECA74764AKOS009031356Thiazole, 4-chloromethyl-2-(3-thienyl)-EN300-57420G28115
Show more names
4-chloromethyl-2-(thiophen-3-yl)-1,3-thiazole4-(Chloromethyl)-2-(3-thienyl)-1,3-thiazole #

Database identifiers

CAS
54747-64-7
PubChem CID
602107
EC Number
890-963-0

Properties

Computed structural properties

XLogP
2.7
Topological polar surface area
69.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
12

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Related reactions

2 records
New reaction record

Compound notes

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