4,4'-Diamino-3,3'-dimethyldiphenylmethane

C₁₅H₁₈N₂CAS 838-88-0226.32 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₅H₁₈N₂
Molar mass: 226.32 g/mol
Exact mass: 226.1470 Da
Melting point: 158 °C
logP: 3.06Crippen estimate
Polar surface area: 52.0 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 2

Hazards

Danger

H302 Harmful if swallowedAcute toxicity, oral
H317 May cause an allergic skin reactionSensitization, Skin
H350 May cause cancerCarcinogenicity
H400 Very toxic to aquatic lifeHazardous to the aquatic environment, acute hazard
H410 Very toxic to aquatic life with long lasting effectsHazardous to the aquatic environment, long-term hazard

Harmonised EU classification (CLP Annex VI, index 612-085-00-7), via PubChem.

Precautionary statements

P203, P261, P264, P270, P272, P273, P280, P301+P317, P302+P352, P318, P321, P330, P333+P317, P362+P364, P391, P405, P501

Identifiers

CAS number

838-88-0

SMILES

Cc1cc(Cc2ccc(N)c(C)c2)ccc1N

InChIKey

WECDUOXQLAIPQW-UHFFFAOYSA-N

InChI

InChI=1S/C15H18N2/c1-10-7-12(3-5-14(10)16)9-13-4-6-15(17)11(2)8-13/h3-8H,9,16-17H2,1-2H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

16 names · show all

4,4′-Diamino-3,3′-dimethyldiphenylmethane
Benzenamine, 4,4′-methylenebis[2-methyl-
o-Toluidine, 4,4′-methylenedi-
4,4′-Methylenebis[2-methylbenzenamine]
3,3′-Dimethyl-4,4′-diaminodiphenylmethane
2,2′-Dimethyl-4,4′-methylenedianiline
4,4′-Methylenedi-o-toluidine
Bis(3-methyl-4-aminophenyl)methane
4,4′-Methylenebis[2-methylaniline]
Kayahard MDT
4,4′-Methylenebis(o-toluidine)
Kayabond C 100
Di(3-methyl-4-aminophenyl)methane
4,4′-Amino-3,3′-dimethyldiphenylmethane
NSC 37146
Bis(4-amino-3-methylphenyl)methane

Work with 4,4'-Diamino-3,3'-dimethyldiphenylmethane

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Tolidine119-93-758 % similar 2,4-Xylidine95-68-156 % similar 2,5-Diaminotoluene95-70-556 % similar 4-Iodo-2-methylaniline13194-68-854 % similar 4-Chloro-o-toluidine95-69-254 % similar 4,4′-Methylenebis[2-ethylbenzenamine]19900-65-353 % similar 4,4′-Methylenebis(2,6-dimethylaniline)4073-98-752 % similar 4,4′-Methylenebis[2-chloroaniline]101-14-452 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

N-Isopropyl-N'-phenyl-p-phenylenediamine101-72-4 Anastrozole 5-methyl analog120511-72-0 1-(1-Naphthylmethyl)piperazine40675-81-8

Elsewhere

PubChem CAS Common Chemistry NIST WebBook