N,N′-Di-2-butyl-1,4-phenylenediamine

C₁₄H₂₄N₂CAS 101-96-2220.36 g/mol

Open in Covalent MOL file

Secondary amine

Properties

Molecular formula: C₁₄H₂₄N₂
Molar mass: 220.36 g/mol
Exact mass: 220.1939 Da
Density: 94 g/mL (at 20 °C)
Melting point: 18 °C
Boiling point: 98 °C (at 0.2 Torr)
Flash point: 132.2 °C (closed cup)
Water solubility: < 1 g/L (20 °C)
logP: 4.11Crippen estimate
Polar surface area: 24.1 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 6

Hazards

Danger

H301 Toxic if swallowed99% of notifiers
H311 Toxic in contact with skin17.8% of notifiers
H314 Causes severe skin burns and eye damage95.9% of notifiers
H317 May cause an allergic skin reaction99% of notifiers
H318 Causes serious eye damage87.5% of notifiers
H400 Very toxic to aquatic life99% of notifiers
H410 Very toxic to aquatic life with long lasting effects93.8% of notifiers

Aggregated from 1,132 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P261, P262, P264, P264+P265, P270, P272, P273, P280, P301+P316, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P333+P317, P361+P364, P362+P364, P363, P391, P405, P501

Identifiers

CAS number

101-96-2

SMILES

CCC(C)Nc1ccc(NC(C)CC)cc1

InChIKey

FSWDLYNGJBGFJH-UHFFFAOYSA-N

InChI

InChI=1S/C14H24N2/c1-5-11(3)15-13-7-9-14(10-8-13)16-12(4)6-2/h7-12,15-16H,5-6H2,1-4H3

Weigh it out

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

Names and synonyms

31 names · show all

N,N'-Di-2-butyl-1,4-phenylenediamine
1,4-Benzenediamine, N1,N4-bis(1-methylpropyl)-
p-Phenylenediamine, N,N′-di-sec-butyl-
1,4-Benzenediamine, N,N′-bis(1-methylpropyl)-
N1,N4-Bis(1-methylpropyl)-1,4-benzenediamine
N,N′-Di-sec-butyl-p-phenylenediamine
Du pont gasoline antioxidant no. 22
Topanol M
N,N′-Di-sec-butyl-n-phenylenediamine
Antioxidant 22
N,N′-Di-sec-butyl-p-phenyldiamine
Tenamene 2
UOP 5
Kerobit BPD
Naugalube 403
Unilink 4100
Sumilizer BPAM 1
Santoflex 44
Cerobit BPD
N,N′-Di-sec-butyl-1,4-phenylenediamine
1,4-Bis-(sec-butylamino)benzene
NSC 68417
N,N′-Bis(1-methylpropyl)-1,4-benzenediamine
Sumilizer BPA
Ethanox 4720
N,N′-Di-2-butyl-p-phenylenediamine
Antioxidant 4720
Santoflex 44PD
Antioxidant 44PD
1-N,4-N-Di(butan-2-yl)benzene-1,4-diamine
N,N'-Di-sec-butyl-p-phenylenediamine

Work with N,N′-Di-2-butyl-1,4-phenylenediamine

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′-Bis(sec-butylamino)diphenylmethane5285-60-980 % similar Eastozone3081-14-956 % similar N-(1-Methylpropyl)-2-butanamine626-23-348 % similar 6PPD793-24-845 % similar N-(1-Ethylpropyl)-3,4-dimethylbenzenamine56038-89-239 % similar 4-Fluoro-N-(1-methylethyl)benzenamine70441-63-337 % similar Butralin33629-47-936 % similar N-Isopropylaniline768-52-536 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1-(1-Adamantyl)piperazine19984-46-4

Elsewhere

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