N,N-dimethyl-m-toluidine
PubChem CID: 8488
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| Compound Synonyms | N,N-Dimethyl-m-toluidine, N,N,3-Trimethylaniline, 121-72-2, Benzenamine, N,N,3-trimethyl-, Dimethyl-m-toluidine, N,N-Dimethyl-3-methylaniline, m,N,N-Trimethylaniline, m-Methyl-N,N-dimethylaniline, N,N-Dimethyl-m-methylaniline, Dimetil-m-toluidina, N,N,3-Trimethylbenzenamine, m-TOLUIDINE, N,N-DIMETHYL-, Benzene, 1-(dimethylamino)-3-methyl-, NSC 1788, Dimetil-m-toluidina [Italian], 3-(Dimethylamino)toluene, EINECS 204-495-6, UNII-P0Q446WN3F, 3-methyl-N,N-dimethylaniline, BRN 1422766, P0Q446WN3F, DTXSID9051618, NSC-1788, N,N-Dimethyl-3-toluidine, n,n-dimethyl-meta-toluidine, Benzeneamine,N,N,3-trimethyl-, DTXCID4030170, 4-12-00-01815 (Beilstein Handbook Reference), aniline, N,N,3-trimethyl-, Dimetilmtoluidina, Dimethylmtoluidine, NSC1788, m,N-Trimethylaniline, MFCD00008305, N,3-Trimethylaniline, m,N,NTrimethylaniline, 3-Dimethylaminotoluene, N,N,3Trimethylaniline, Dimethyl-m-tolyl-amine, mToluidine, N,Ndimethyl, mMethylN,Ndimethylaniline, N,NDimethylmmethylaniline, m-Toluidine,N-dimethyl-, N,NDimethyl3methylaniline, N,N,3Trimethylbenzenamine, Benzenamine,N,3-trimethyl-, SCHEMBL12879, Benzenamine, N,N,3trimethyl, Benzene, 1(dimethylamino)3methyl, N,N-Dimethyl-m-toluidine, 97%, AAA12172, Tox21_303992, AKOS016010566, CS-W013338, NCGC00357212-01, CAS-121-72-2, LS-13653, DB-041627, D0806, NS00023975, EN300-142022, F11206, Q27285968, 204-495-6 |
|---|---|
| Topological Polar Surface Area | 3.2 |
| Hydrogen Bond Donor Count | 0.0 |
| Inchi Key | CWOMTHDOJCARBY-UHFFFAOYSA-N |
| Rotatable Bond Count | 1.0 |
| Synonyms | Benzenamine, N,N,3-trimethyl-, Benzene, 1-(dimethylamino)-3-methyl-, Benzeneamine,N,N,3-trimethyl-, Dimethyl-m-toluidine, Dimetil-m-toluidina, M-methyl-n,n-dimethylaniline, M-toluidine, n,n-dimethyl-, M, n,n-trimethylaniline, M,n,n-trimethylaniline, N, N-Dimethyl-3-methylaniline, N, n-dimethyl-m-methylaniline, N,N-Dimethyl-3-methylaniline, N,N-Dimethyl-3-toluidine, N,n-dimethyl-m-ethylaniline, N,n-dimethyl-m-methylaniline, N,n-dimethyl-m-toluidine, N,N,3-Trimethylaniline, N,N,3-Trimethylbenzenamine |
| Heavy Atom Count | 10.0 |
| Compound Name | N,N-dimethyl-m-toluidine |
| Description | N,n-dimethyl-3-methylaniline is a member of the class of compounds known as aminotoluenes. Aminotoluenes are organic aromatic compounds containing a benzene that carries a single methyl group and one amino group. N,n-dimethyl-3-methylaniline is slightly soluble (in water) and a very strong basic compound (based on its pKa). N,n-dimethyl-3-methylaniline can be found in sweet orange, which makes n,n-dimethyl-3-methylaniline a potential biomarker for the consumption of this food product. |
| Exact Mass | 135.105 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 135.105 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 98.9 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 135.21 |
| Database Name | fooddb_chem_all;pubchem |
| Covalent Unit Count | 1.0 |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | N,N,3-trimethylaniline |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Inchi | InChI=1S/C9H13N/c1-8-5-4-6-9(7-8)10(2)3/h4-7H,1-3H3 |
| Smiles | CC1=CC(=CC=C1)N(C)C |
| Xlogp | 2.8 |
| Defined Bond Stereocenter Count | 0.0 |
| Molecular Formula | C9H13N |
- 1. Outgoing r'ship
FOUND_INto/from Citrus Sinensis (Plant) Rel Props:Source_db:fooddb_chem_all