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2-Ethoxybenzothiazole

HCID 3434154
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
70292-64-7
Standard SMILES
CCOc1nc2ccccc2s1
InChIKey
LLQCHJGEDKLPOX-UHFFFAOYSA-N
Molecular formula
C9H9NOS
Average molar mass
179.24 g/mol
Monoisotopic mass
179.04048491

Names & identifiers

Preferred name
2-Ethoxybenzothiazole
IUPAC
2-ethoxy-1,3-benzothiazole
English name
Benzothiazole, 2-ethoxy- (9CI)
Molecular formula
C9H9NOS
Molecular weight
179.24

Names & synonyms

2-ethoxybenzothiazoleRefChem:471645660-205-12-ethoxy-1,3-benzothiazole70292-64-72-ethoxybenzo[d]thiazoleethoxybenzothiazoleSCHEMBL6842459DTXSID90392441LLQCHJGEDKLPOX-UHFFFAOYSA-N1,3-benzothiazol-2-yl ethyl etherAKOS024324661
Show more names
Benzothiazole, 2-ethoxy-Benzothiazole, 2-ethoxy- (9CI)
DA-03414

Database identifiers

CAS
70292-64-7
PubChem CID
3434154
DTXSID
DTXSID90392441
EC Number
660-205-1
Nikkaji
J1.178.560C

Properties

Computed structural properties

XLogP
2.9
Topological polar surface area
50.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
12
Formal charge
0
Complexity
153

Physicochemical properties

Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
319 · H319-H302
Precautionary statements
264 · P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P

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 · 4 items

Warning

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

P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 38 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 CategoriesAcute Tox. 4 (100%)

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H319-H302
Precautionary statements
P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P

Chemistry & industry

Suppliers3 total

CHEMSTEP[email protected]
德拜科技有限公司00852-2521 1836
西格玛奥德里奇(上海)贸易有限公司21-20338288 · [email protected]

Related reactions

2 records
New reaction record
HRID 28188 reaction equation
HRID 28188As productuspto-grants-1980_09
HRID 807990 reaction equation
HRID 807990As productTest data from https://doi.org/10.1039/C8SC04228D

Compound notes

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