Basic information
- CAS
43088-00-2- Standard SMILES
Nc1ccc(-c2nc3ccccc3s2)c(Cl)c1- InChIKey
DRFGKQLPMWOHTF-UHFFFAOYSA-N- Molecular formula
- C13H9ClN2S
- Average molar mass
- 260.74 g/mol
- Monoisotopic mass
- 260.0174972
Names & identifiers
- Preferred name
- 4-Benzothiazol-2-yl-3-chloro-phenylamine
- IUPAC
- 4-(1,3-benzothiazol-2-yl)-3-chloroaniline
- English name
- 4-Benzothiazol-2-yl-3-chloro-phenylamine
- Molecular formula
- C13H9ClN2S
- Molecular weight
- 260.74
Names & synonyms
43088-00-24-Benzothiazol-2-yl-3-chloro-phenylamineDTXSID10349876RefChem:290247DTXCID503009464-(1,3-benzothiazol-2-yl)-3-chloroaniline4-(benzo[d]thiazol-2-yl)-3-chloroaniline4-Benzothiazol-2-yl-3-chlorophenylamineBenzenamine, 4-(2-benzothiazolyl)-3-chloro-CHEMBL112327SCHEMBL1977551MFCD00937704
Show more names
AKOS BB-8016ASISCHEM T31096
STK390513AKOS000108511CCG-125315NCGC00165327-01VS-03187CS-0327350ST500172354-(1,3-benzothiazol-2-yl)-3-chloro-aniline
Database identifiers
- CAS
43088-00-2- PubChem CID
- 667682
- DTXSID
DTXSID10349876- ChEMBL
CHEMBL112327- EC Number
- 673-332-2
- Nikkaji
- J763.763B
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 67.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 276
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H319-H312-H315-H302-H332
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P280-P302+P352-P312-P322-P363-P501-P261-P271-P304+P340-P312-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
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
- H335-H319-H312-H315-H302-H332
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P280-P302+P352-P312-P322-P363-P501-P261-P271-P304+P340-P312-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Suppliers2 total
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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