3-Methyl-N,N-di(propan-2-yl)benzamide
Basic information
- CAS
5448-36-2- Standard SMILES
Cc1cccc(C(=O)N(C(C)C)C(C)C)c1- InChIKey
WPFBQNDWEOVSGC-UHFFFAOYSA-N- Molecular formula
- C14H21NO
- Average molar mass
- 219.32 g/mol
- Monoisotopic mass
- 219.16231429
Names & identifiers
- Preferred name
- 3-Methyl-N,N-di(propan-2-yl)benzamide
- IUPAC
- 3-methyl-N,N-di(propan-2-yl)benzamide
- English name
- 3-methyl-N,N-dipropan-2-yl-benzamide
- Molecular formula
- C14H21NO
- Molecular weight
- 219.32
Names & synonyms
5448-36-2N,N-Diisopropyl-3-methylbenzamide3-methyl-n,n-di(propan-2-yl)benzamide3-METHYL-N,N-BIS(1-METHYLETHYL)BENZAMIDE3-Methyl-N,N-bis(isopropyl)benzamideZ83YU4P5VVNSC-17936Benzamide, 3-methyl-N,N-bis(1-methylethyl)-DTXSID30877621NSC 17936M-TOLUAMIDE, N,N-DIISOPROPYL-RefChem:198358
Show more names
N,N-Diisopropyl-3-methylbenzamide,97%
DTXCID6010156943-methyl-N,N-bis(propan-2-yl)benzamideNSC179363-methyl-N,N-dipropan-2-yl-benzamideCBMicro_015287UNII-Z83YU4P5VVCambridge id 5267036N,N-diisopropyl-3-methyl-benzamide
Database identifiers
- CAS
5448-36-2- PubChem CID
- 226948
- DTXSID
DTXSID30877621- UNII
- Z83YU4P5VV
- Nikkaji
- J419.208G
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 227
Experimental & physicochemical properties
LogP3.0
Physicochemical properties
- FDA UNII
- 83 YU4P5VV · Z83YU4P5VV
- Symbol(GHS)
- 7 · GHS07
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P302+P352-P305+P351+P338-P321-P405-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.
Safety data
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P302+P352-P305+P351+P338-P321-P405-P501
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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