Basic information
- CAS
29095-44-1- Standard SMILES
CN(C)C(=O)C(=O)c1c[nH]c2ccccc12- InChIKey
FIUGYEVWNQNDDO-UHFFFAOYSA-N- Molecular formula
- C12H12N2O2
- Average molar mass
- 216.24 g/mol
- Monoisotopic mass
- 216.08987763
Names & identifiers
- Preferred name
- 2-(1H-Indol-3-yl)-N,N-dimethyl-2-oxo-acetamide
- IUPAC
- 2-(1H-indol-3-yl)-N,N-dimethyl-2-oxoacetamide
- English name
- Indole-3-(N,N-dimethyl)glyoxylamide
- Molecular formula
- C12H12N2O2
- Molecular weight
- 216.24
Names & synonyms
29095-44-12-(1H-Indol-3-yl)-N,N-dimethyl-2-oxo-acetamide3-IndolylglyoxyldimethylamideN,N-Dimethylindole-3-glyoxylamideN,N-Dimethyl-alpha-oxo-1H-indole-3-acetamideINDOLE-3-GLYOXYLAMIDE, N,N-DIMETHYL-1H-Indole-3-acetamide, N,N-dimethyl-alpha-oxo-EINECS 249-429-76H7BWU2Q2PNSC 71955BRN 0179523NSC-71955
Show more names
n,n-dimethyl-indole-3-glyoxylamidIndole-3-(N,N-dimethyl)glyoxylamideN,N-Dimethyl-α-oxo-1H-indole-3-acetamideN,N-dimethyl-α-oxo-1H-indole-3-acetamide1H-Indole-3-acetamide, N,N-dimethyl-α-oxo-n,n-dimethyl-alpha-oxo-1h-indole-3-acetamid
1H-Indole-3-acetamide, N,N-dimethyl-.alpha.-oxo-N,N-DIMETHYL-3-INDOLEGLYOXYLAMIDERefChem:451456249-429-72-(1H-Indol-3-yl)-N,N-dimethyl-2-oxoacetamideUNII-6H7BWU2Q2PNSC71955CBMicro_024633
Database identifiers
- CAS
29095-44-1- PubChem CID
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 53.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 301
Physicochemical properties
- Melting point
- 159 · 159-160 °C(Solv: ethyl acetate (141-78-6); methylcyclohexane (108-87-2))
- Boiling point
- 399.6 · 399.6±34.0 °C(Predicted)
- Density
- 1.266 · 1.266±0.06 g/cm3(Predicted)
- pka
- 14.76 · 14.76±0.30(Predicted)
- FDA UNII
- 6 H7BWU2Q2P · 6H7BWU2Q2P
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H315-H302-H335
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501-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, 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 38 reports by companies from 1 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-H315-H302-H335
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers3 total
陕西缔都医药化工有限公司029-88380327 17691182729 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
AFINE CHEMICALS LIMITED+86-571-85134551 +86-18958018566 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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