4,4′-Methylenebis(2,6-dimethylaniline)

C₁₇H₂₂N₂CAS 4073-98-7254.38 g/mol

Open in Covalent MOL file

Primary amine

Properties

Molecular formula: C₁₇H₂₂N₂
Molar mass: 254.38 g/mol
Exact mass: 254.1783 Da
Melting point: 122.5–123.5 °C
logP: 3.68Crippen estimate
Polar surface area: 52.0 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 2

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
H312 Harmful in contact with skin100% of notifiers
H315 Causes skin irritation100% of notifiers
H317 May cause an allergic skin reaction72.3% of notifiers
H319 Causes serious eye irritation99.3% of notifiers
H332 Harmful if inhaled100% of notifiers
H335 May cause respiratory irritation100% of notifiers
H351 Suspected of causing cancer70.9% of notifiers
H400 Very toxic to aquatic life70.3% of notifiers
H410 Very toxic to aquatic life with long lasting effects70.3% of notifiers

Aggregated from 148 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P203, P261, P264, P264+P265, P270, P271, P272, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P318, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P391, P403+P233, P405, P501

Identifiers

CAS number

4073-98-7

SMILES

Cc1cc(Cc2cc(C)c(N)c(C)c2)cc(C)c1N

InChIKey

OMHOXRVODFQGCA-UHFFFAOYSA-N

InChI

InChI=1S/C17H22N2/c1-10-5-14(6-11(2)16(10)18)9-15-7-12(3)17(19)13(4)8-15/h5-8H,9,18-19H2,1-4H3

Weigh it out

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

Names and synonyms

12 names

Benzenamine, 4,4′-methylenebis[2,6-dimethyl-
2,6-Xylidine, 4,4′-methylenedi-
4,4′-Methylenebis[2,6-dimethylbenzenamine]
4,4′-Methylenedi-2,6-xylidine
4,4′-Methylenebis(2,6-xylidine)
3,3′,5,5′-Tetramethyl-4,4′-diaminodiphenylmethane
Kayabond C 200
Kayabond C 200S
C 200S
3,3′,5,5′-Tetramethyl-4,4′-methylene dianiline
Bis(4-amino-3,5-dimethylphenyl)methane
4,4'-Methylenebis(2,6-xylidine)

Work with 4,4′-Methylenebis(2,6-dimethylaniline)

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

4,4'-Methylenebis(2-ethyl-6-methylaniline)19900-72-267 % similar 3,3′,5,5′-Tetramethylbenzidine54827-17-759 % similar 2,4,6-Trimethylaniline88-05-157 % similar 4-Amino-3,5-dimethylphenol3096-70-654 % similar 4-Iodo-2,6-dimethylbenzenamine4102-53-854 % similar 4-Chloro-2,6-dimethylaniline24596-18-752 % similar 4-Bromo-2,6-dimethylbenzenamine24596-19-852 % similar 4,4'-Methylenebis(2,6-dimethylphenol)5384-21-452 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Tetramethyldiaminodiphenylmethane101-61-1 4,4′-Methylenebis[2-ethylbenzenamine]19900-65-3

Elsewhere

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