2-Thiazoline, 2-anilino-
Basic information
- CAS
1009-70-7- Standard SMILES
c1ccc(NC2=NCCS2)cc1- InChIKey
NNRDYOXKIWFNPP-UHFFFAOYSA-N- Molecular formula
- C9H10N2S
- Average molar mass
- 178.26 g/mol
- Monoisotopic mass
- 178.0564695
Names & identifiers
- Preferred name
- 2-Thiazoline, 2-anilino-
- IUPAC
- N-phenyl-4,5-dihydro-1,3-thiazol-2-amine
- English name
- 2-(Phenylamino)-4,5-dihydrothiazole
- Molecular formula
- C9H10N2S
- Molecular weight
- 178.25
Names & synonyms
1009-70-72-Anilino-2-thiazoline2-Thiazoline, 2-anilino-DTXSID20143564RefChem:483734DTXCID3066055653-622-5N-Phenyl-4,5-dihydro-1,3-thiazol-2-amine2-(Phenylamino)-4,5-dihydrothiazoleN-Phenyl-4,5-dihydrothiazol-2-amine2-Thiazolamine, 4,5-dihydro-N-phenyl-MFCD00022433
Show more names
2-(Phenylimino)thiazolidineN-Phenylthiazolidine-2-imineN-Phenyl-2-thiazoline-2-amineN-(Thiazolidine-2-ylidene)aniline
Benzenamine, N-2-thiazolidinylidene-IFLab1_003631phenyliminothiazolidine2-phenylaminothiazoline2-phenyliminothiazolidineMLS001005623SCHEMBL6265222SCHEMBL6265227
Database identifiers
- CAS
1009-70-7- PubChem CID
- 70521
- DTXSID
DTXSID20143564- ChEMBL
CHEMBL1421075- EC Number
- 653-622-5
- Nikkaji
- J102.647J
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 49.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 173
Experimental & physicochemical properties
SpringerMaterials Properties15N nuclear magnetic resonance spectrum
Solubility23.5 [ug/mL] (The mean of the results at pH 7.4)
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H302-H335-H315
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
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
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)
Aggregated GHS information provided per 39 reports by companies from 2 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-H335-H315
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Suppliers
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Related reactions
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Compound notes
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