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4-(4-Ethylphenyl)-1,3-thiazol-2-amine

HCID 733908
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Basic information

CAS
85112-35-2
Standard SMILES
CCc1ccc(-c2csc(N)n2)cc1
InChIKey
YDFOGNLELPWXHU-UHFFFAOYSA-N
Molecular formula
C11H12N2S
Average molar mass
204.29 g/mol
Monoisotopic mass
204.07211956

Names & identifiers

Preferred name
4-(4-Ethylphenyl)-1,3-thiazol-2-amine
IUPAC
4-(4-ethylphenyl)-1,3-thiazol-2-amine
English name
4-(4-Ethyl-phenyl)-thiazol-2-ylamine
Molecular formula
C11H12N2S
Molecular weight
204.29

Names & synonyms

85112-35-24-(4-ethylphenyl)-1,3-thiazol-2-amineDTXSID20352699RefChem:287997DTXCID403037644-(4-Ethyl-phenyl)-thiazol-2-ylamine4-(4-ethylphenyl)thiazol-2-amineMFCD014714964-(4-ethylphenyl)-1,3-thiazole-2-ylamine2-Thiazolamine,4-(4-ethylphenyl)-2-amino-4-(4'-ethylphenyl)-thiazoleCBMicro_032269
Show more names
4-(4-ethylphenyl)-2-thiazolamine2-Thiazolamine, 4-(4-ethylphenyl)-4-(4-ethylphenyl)-1,3-thiazol-2-amine(SALTDATA: FREE)
MixCom6_001933Oprea1_047399CBDivE_009958SCHEMBL476184IFLab1_003845YDFOGNLELPWXHU-UHFFFAOYSA-NALBB-001548BBL020241

Database identifiers

CAS
85112-35-2
PubChem CID
733908
DTXSID
DTXSID20352699
EC Number
157-135-4

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
67.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
14
Formal charge
0
Complexity
178

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]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+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%)

Chemistry & industry

Upstream & downstream products

Upstream raw materials

4-EthylacetophenoneCarbamimidothioic acid

Related reactions

1 records
New reaction record
HRID 1732299 reaction equation
HRID 1732299As reactantuspto-grants-1980_12

Compound notes

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