Basic information
- CAS
188758-93-2- Standard SMILES
CN(C)CCNC(=O)c1ccc(N)cc1- InChIKey
AOXIUIPADQFJLG-UHFFFAOYSA-N- Molecular formula
- C11H17N3O
- Average molar mass
- 207.27 g/mol
- Monoisotopic mass
- 207.13716216
Names & identifiers
- Preferred name
- 4-amino-N-(2-(dimethylamino)ethyl)benzamide
- IUPAC
- 4-amino-N-[2-(dimethylamino)ethyl]benzamide
- English name
- 4-amino-N-[2-(dimethylamino)ethyl]benzamide
- Molecular formula
- C11H17N3O
- Molecular weight
- 207.27
Names & synonyms
188758-93-24-amino-N-[2-(dimethylamino)ethyl]benzamide4-Amino-N-(2-(dimethylamino)ethyl)benzamideDTXSID90330247RefChem:1070305DTXCID50281342MFCD016667324-Amino-N-[2-(dimethylamino)ethyl]-benzamideorb3027257SCHEMBL1409860SCHEMBL6882330NIOSH/CV2304000
Show more names
Benzamide, 4-amino-N-[2-(dimethylamino)ethyl]-
AOXIUIPADQFJLG-UHFFFAOYSA-NNHA75893SBB093912AKOS000127767SS-3976DA-088384-amino-N-(2-dimethylamino-ethyl)-benzamideCS-0448921
Database identifiers
- CAS
188758-93-2- PubChem CID
- 428214
- DTXSID
DTXSID90330247
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 58.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 198
Physicochemical properties
- Boiling point
- 400.4 · 400.4±30.0 °C(Predicted)
- Density
- 1.097 · 1.097±0.06 g/cm3(Predicted)
- pka
- 15.47 · 15.47±0.46(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- HazardClass
- IRRITANT
Safety & regulation
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_class
- IRRITANT
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers3 total
TargetMol 中国(陶术生物)400-821-0310 15002144251 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 4008675858 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
Related reactions
4 records
Compound notes
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