Basic information
- CAS
19532-98-0- Standard SMILES
CNC(=O)c1ccccc1C(=O)NC- InChIKey
OAJRKNFPHGSOSX-UHFFFAOYSA-N- Molecular formula
- C10H12N2O2
- Average molar mass
- 192.21 g/mol
- Monoisotopic mass
- 192.08987763
Names & identifiers
- Preferred name
- N,N'-dimethylphthalamide
- IUPAC
- 1-N,2-N-dimethylbenzene-1,2-dicarboxamide
- English name
- Milnacipran Related Impurity 3
- Molecular formula
- C10H12N2O2
- Molecular weight
- 192.21
Names & synonyms
19532-98-0N,N'-dimethylphthalamideDTXSID70412292RefChem:358498DTXCID60363143N1,N2-DimethylphthalamideN1,N2-DIMETHYLBENZENE-1,2-DICARBOXAMIDE1,2-Benzenedicarboxamide, N,N'-dimethyl-MFCD000867411-N,2-N-dimethylbenzene-1,2-dicarboxamideN1,N2-Dimethyl-1,2-benzenedicarboxamideMilnacipran Impurity 3
Show more names
OMAD-007Rivaroxaban Imp XMinapram Impurity 3Lafutidine Impurity 12Amlodipine Impurity 43N,N-DimethylphthalamideRivaroxaban Impurity 127Milnacipran impurities1238N1,N2-dimethylphthalamic acid
Rivaroxaban impurity 193LLH38FGP4MSCHEMBL2344909OAJRKNFPHGSOSX-UHFFFAOYSA-NAKOS027447545n,n'-dimethyl-1,2-benzenedicarboxamideAS-60075SY412000
Database identifiers
- CAS
19532-98-0- PubChem CID
- 5237652
- DTXSID
DTXSID70412292- UNII
- LLH38FGP4M
- Nikkaji
- J1.327.355C
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 204
Physicochemical properties
- Melting point
- 185 °C · 185 °C (decomp)
- Boiling point
- 453 · 453.0±28.0 °C(Predicted)
- Density
- 1.129 · 1.129±0.06 g/cm3(Predicted)
- storage temp.
- Refrigerator, under inert atmosphere
- solubility
- Chloroform (Very Slightly, Heated), DMSO (Slightly), Methanol (Slightly, Heated)
- form
- Solid
- pka
- 14.12 · 14.12±0.46(Predicted)
- color
- White to Off-White
- Stability
- Moisture Sensitive
- InChI
- InChI=1S/C10H12N2O2/c1-11-9(13)7-5-3-4-6-8(7)10(14)12-2/h3-6H,1-2H3,(H,11,13)(H,12,14)
- InChIKey
- OAJRKNFPHGSOSX-UHFFFAOYSA-N
- SMILES
- C1(C(NC)=O)=CC=CC=C1C(NC)=O
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319
- Precautionary statements
- P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
Chemistry & industry
Applications
UsesN,N''-Dimethylphthalamide is a impurity derived from phthalamide (P384550). Phthalimide is a reagent used to transform allyl- and alkyl halides into protected primary amines. Phthalimide analogues have been extensively used in medicinal chemistry owing to their wide spectrum of applications as anti-convulsant, anti-inflammatory, analgesic, hypolipidimic and immunomodulatory activities.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers74 total
天津始加生物医药科技有限公司15022261580 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
济南百隆化学有限公司[email protected] · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
怀化元研达生物技术有限责任公司18711085600 · [email protected]
Related reactions
1 records
Compound notes
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