(Dimethylaminomethyl)styrene

C₁₁H₁₅NCAS 2245-52-5161.25 g/mol

Open in Covalent MOL file

Alkene Tertiary amine

Properties

Molecular formula: C₁₁H₁₅N
Molar mass: 161.25 g/mol
Exact mass: 161.1204 Da
logP: 2.39Crippen estimate
Polar surface area: 3.2 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 3

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation100% of notifiers

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

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

2245-52-5

SMILES

CN(C)CC1=CC=C(C=C1)C=C

InChIKey

XQBHAZDVLGNSOJ-UHFFFAOYSA-N

InChI

InChI=1S/C11H15N/c1-4-10-5-7-11(8-6-10)9-12(2)3/h4-8H,1,9H2,2-3H3

Weigh it out

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

Names and synonyms

1 names

Benzenemethanamine, ar-ethenyl-N,N-dimethyl-

Work with (Dimethylaminomethyl)styrene

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

P,P'-Divinyl-1,2-diphenylethane48174-52-358 % similar Dimethylbenzylamine103-83-350 % similar (4-Vinylphenyl)methanol1074-61-950 % similar 4-Vinylbenzyl chloride1592-20-750 % similar 4-Vinylbenzylamine (stabilized with MEHQ)50325-49-050 % similar 4-Amino-N,N-dimethylbenzenemethanamine6406-74-250 % similar 4-Vinyltoluene622-97-945 % similar 4,4′-Diethenyl-1,1′-biphenyl4433-13-044 % similar

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

Same formula

2-(2-Methylphenyl)pyrrolidine129540-23-4 1-Cyanoadamantane23074-42-2 2-Phenylpiperidine3466-80-6 Adamantane-2-carbonitrile35856-00-9 3-Phenylpiperidine3973-62-4 N-Phenylpiperidine4096-20-2 4-Phenylpiperidine771-99-3

Elsewhere

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