3-Amino-N,N-dimethylbenzamide
Basic information
- CAS
33322-60-0- Standard SMILES
CN(C)C(=O)c1cccc(N)c1- InChIKey
LZPLRAXAVPPVSX-UHFFFAOYSA-N- Molecular formula
- C9H12N2O
- Average molar mass
- 164.2 g/mol
- Monoisotopic mass
- 164.09496301
Names & identifiers
- Preferred name
- 3-Amino-N,N-dimethylbenzamide
- IUPAC
- 3-amino-N,N-dimethylbenzamide
- English name
- 3-AMINO-N,N-DIMETHYLBENZAMIDE
- Molecular formula
- C9H12N2O
- Molecular weight
- 164.2
Names & synonyms
3-Amino-N,N-dimethylbenzamide33322-60-0Benzamide, 3-amino-N,N-dimethyl-m-Amino-N,N-dimethylbenzamideDTXSID003298893-NH2-C6H4CON(CH3)2RefChem:92949DTXCID80280984808-790-6LZPLRAXAVPPVSX-UHFFFAOYSA-NMFCD011689053-Amino-N,N-dimethyl-benzamide
Show more names
BUTTPARK 25\02-28CHEMBRDG-BB 5759313OTAVA-BB BB01173800953-amino-N,N-dimethylbenzamide(SALTDATA: FREE)
Oprea1_845356N,N-Dimethyl-3-aminobenzamideSCHEMBL1172823STL068779(3-aminophenyl)-N,N-dimethylcarboxamideSCHEMBL2551558SBB015313AKOS000111618
Database identifiers
- CAS
33322-60-0- PubChem CID
- 424774
- DTXSID
DTXSID00329889- EC Number
- 808-790-6
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 46.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 168
Physicochemical properties
- Melting point
- 87 · 87-88 °C
- Boiling point
- 351.6 · 351.6±25.0 °C(Predicted)
- Density
- 1.116 · 1.116±0.06 g/cm3(Predicted)
- storage temp.
- Keep in dark place,Inert atmosphere,Room temperature
- pka
- 3.57 · 3.57±0.10(Predicted)
- form
- solid
- Appearance
- Light yellow to brown Solid
- InChI
- 1S/C9H12N2O/c1-11(2)9(12)7-4-3-5-8(10)6-7/h3-6H,10H2,1-2H3
- InChIKey
- LZPLRAXAVPPVSX-UHFFFAOYSA-N
- SMILES
- O=C(N(C)C)C1=CC=CC(N)=C1
- UNSPSC Code
- 12352200 · 12352200
- NACRES
- 21 · NA.21
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 317 · H317
- Precautionary statements
- 261 · P261-P272-P280-P302+P352-P333+P313-P321-P363-P501
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
H317 (97.5%): May cause an allergic skin reaction [Warning Sensitization, Skin]
P261, P272, P280, P302+P352, P321, P333+P317, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 40 reports by companies from 2 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Sens. 1 (97.5%)
Safety data
- wgk
- WGK 3
- hs_code
- 2924297099
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_class
- IRRITANT
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H317
- Hazard Classifications
- Skin Sens. 1
- Precautionary statements
- P261-P272-P280-P302+P352-P333+P313-P321-P363-P501
Suppliers
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Related reactions
11 records
Compound notes
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