Basic information
- CAS
91350-17-3- Standard SMILES
Cc1ccc2[nH]cc(CC(N)=O)c2c1- InChIKey
VQXXRQMLQUGSQL-UHFFFAOYSA-N- Molecular formula
- C11H12N2O
- Average molar mass
- 188.23 g/mol
- Monoisotopic mass
- 188.09496301
Names & identifiers
- Preferred name
- 5-Methylindole-3-acetamide
- IUPAC
- 2-(5-methyl-1H-indol-3-yl)acetamide
- English name
- 5-Methylindole-3-acetamide
- Molecular formula
- C11H12N2O
- Molecular weight
- 188.23
Names & synonyms
5-METHYLINDOLE-3-ACETAMIDERefChem:537285654-417-32-(5-methyl-1H-indol-3-yl)acetamide91350-17-3NSC88878NCIOpen2_001333SCHEMBL1395838DTXSID00293354VQXXRQMLQUGSQL-UHFFFAOYSA-N1H-Indole-3-acetamide, 5-methyl-NSC-88878
Show more names
AKOS006273753
Database identifiers
- CAS
91350-17-3- PubChem CID
- 259192
- DTXSID
DTXSID00293354- EC Number
- 654-417-3
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 58.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 229
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07,GHS05
- Signal word
- Danger
- Hazard statements
- 318 · H318-H302-H315-H335
- Precautionary statements
- 280 · P280-P305+P351+P338-P310-P264-P270-P301+P312-P330-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
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+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
- Danger
- Symbol(GHS)
- GHS07,GHS05
- Hazard statements
- H318-H302-H315-H335
- Precautionary statements
- P280-P305+P351+P338-P310-P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Suppliers2 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
SIGMAALDRICH—
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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