Basic information
- CAS
33405-06-0- Standard SMILES
O=C(Nc1ccccc1C(=O)O)c1cccs1- InChIKey
OGUBBDMPILZTQG-UHFFFAOYSA-N- Molecular formula
- C12H9NO3S
- Average molar mass
- 247.27 g/mol
- Monoisotopic mass
- 247.03031432
Names & identifiers
- Preferred name
- 2-(Thiophene-2-amido)benzoic acid
- IUPAC
- 2-(thiophene-2-carbonylamino)benzoic acid
- English name
- 2-[(THIEN-2-YLCARBONYL)AMINO]BENZOIC ACID
- Molecular formula
- C12H9NO3S
- Molecular weight
- 247.27
Names & synonyms
33405-06-02-(thiophene-2-amido)benzoic acidRefChem:462425102-561-82-[(thien-2-ylcarbonyl)amino]benzoic acid2-(Thiophene-2-carboxamido)benzoic acid2-(thiophene-2-carbonylamino)benzoic acid2-(2-thienylcarbonylamino)benzoic acidCBMicro_016046Oprea1_349294Oprea1_498077SCHEMBL13701150
Show more names
Benzoic acid, 2-[(2-thienylcarbonyl)amino]-2-[(Thiophen-2-ylcarbonyl)amino]benzoic acid
SCHEMBL38652227HMS1662D16CCG-5160STK414471AKOS0001292992-(Thiophene-2-carboxamido)benzoicacid2-[(2-thienylcarbonyl)amino]benzoic acidSY019345
Database identifiers
- CAS
33405-06-0- PubChem CID
- 643302
- EC Number
- 102-561-8
- Nikkaji
- J1.509.317J
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 94.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 308
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
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)
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
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers6 total
无锡丽恒昇生物医药科技有限公司15250805028 15250805028 · [email protected]
常州探索化学有限公司15295164949 · [email protected]
常州探索化学有限公司+8615295164949 · [email protected]
常州千艾生物科技有限公司051915240519135 13961152745 · [email protected]
南京康满林化工实业有限公司025-83697070 13770331960 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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