N,N-Diethyl-o-toluidine

C₁₁H₁₇NCAS 606-46-2163.26 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₁H₁₇N
Molar mass: 163.26 g/mol
Exact mass: 163.1361 Da
Melting point: −60 °C
Boiling point: 209 °C
logP: 2.84Crippen estimate
Polar surface area: 3.2 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 3

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
H312 Harmful in contact with skin100% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H332 Harmful if inhaled100% of notifiers

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

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P321, P330, P332+P317, P337+P317, P362+P364, P501

Identifiers

CAS number

606-46-2

SMILES

CCN(CC)c1ccccc1C

InChIKey

YQYUUNRAPYPAPC-UHFFFAOYSA-N

InChI

InChI=1S/C11H17N/c1-4-12(5-2)11-9-7-6-8-10(11)3/h6-9H,4-5H2,1-3H3

Weigh it out

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

Names and synonyms

7 names

Benzenamine, N,N-diethyl-2-methyl-
o-Toluidine, N,N-diethyl-
N,N-Diethyl-2-methylbenzenamine
2-(Dimethylamino)toluene
N,N-Diethyl-2-methylaniline
N,N-Diethyl-o-methylaniline
NSC 8708

Work with N,N-Diethyl-o-toluidine

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2-Mepp39512-51-157 % similar N,N-Diethyl-1-naphthalenamine84-95-753 % similar Dimethyl-o-toluidine609-72-352 % similar 2-(Aminomethyl)-N,N-diethylaniline334009-12-052 % similar N-(2-Methylphenyl)piperazine hydrochloride70849-60-452 % similar Diethylaniline91-66-748 % similar Crotamiton483-63-647 % similar O-Xylene95-47-643 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

2-Hexylpyridine1129-69-7 N,N,2,4,6-Pentamethylbenzenamine13021-15-3 N-Butylbenzylamine2403-22-7 2,6-Diethyl-4-methylbenzenamine24544-08-9 4-Pentylaniline33228-44-3 N-(1,1-Dimethylethyl)benzenemethanamine3378-72-1 4-(1,1-Dimethylethyl)benzenemethanamine39895-55-1 4-N-Butylbenzylamine57802-79-6

Elsewhere

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