5-[(2,5-Dichlorophenyl)methyl]-1,3-thiazol-2-amine
Basic information
- CAS
405921-35-9- Standard SMILES
Nc1ncc(Cc2cc(Cl)ccc2Cl)s1- InChIKey
WXXIGOUTTGOBQI-UHFFFAOYSA-N- Molecular formula
- C10H8Cl2N2S
- Average molar mass
- 259.15 g/mol
- Monoisotopic mass
- 257.9785248
Names & identifiers
- Preferred name
- 5-[(2,5-Dichlorophenyl)methyl]-1,3-thiazol-2-amine
- IUPAC
- 5-[(2,5-dichlorophenyl)methyl]-1,3-thiazol-2-amine
- English name
- 5-(2,5-dichlorobenzyl)-1,3-thiazol-2-amine
- Molecular formula
- C10H8Cl2N2S
- Molecular weight
- 259.15
Names & synonyms
5-[(2,5-dichlorophenyl)methyl]-1,3-thiazol-2-amine5-((2,5-dichlorophenyl)methyl)-1,3-thiazol-2-amineRefChem:528516841-669-6405921-35-95-(2,5-Dichloro-benzyl)-thiazol-2-ylamine5-(2,5-Dichlorobenzyl)thiazol-2-amine5-(2,5-dichlorobenzyl)-1,3-thiazol-2-amineMFCD019101602-amino-5-(2,5-dichlorobenzyl)-1,3-thiazoleOprea1_459666DTXSID10352047
Show more names
2-Thiazolamine, 5-[(2,5-dichlorophenyl)methyl]-
AKOS000122187WAY-636305DA-38817CS-0218948EN300-02542G579465-[(2,5-dichlorophenyl)methyl]thiazol-2-amineZ57035155
Database identifiers
- CAS
405921-35-9- PubChem CID
- 717342
- DTXSID
DTXSID10352047- EC Number
- 841-669-6
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 67.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 218
Physicochemical properties
- Melting point
- 124 · 124-125 °C(Solv: chloroform (67-66-3); carbon tetrachloride (56-23-5))
- Boiling point
- 403.5 · 403.5±35.0 °C(Predicted)
- Density
- 1.458 · 1.458±0.06 g/cm3(Predicted)
- pka
- 4.83 · 4.83±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H332-H302-H335-H312-H315
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P261-P271-P304+P340-P312-P264-P280-P305+P351+P338-P337+P313P-P280-P302+P352-P312-P322-P363-P501-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, P317, 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%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319-H332-H302-H335-H312-H315
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P261-P271-P304+P340-P312-P264-P280-P305+P351+P338-P337+P313P-P280-P302+P352-P312-P322-P363-P501-P264-P280-P302+P352-P321-P332+P313-P362
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Related reactions
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Compound notes
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