Antazoline

C₁₇H₁₉N₃CAS 91-75-8265.36 g/mol

Open in Covalent MOL file

Amidine Tertiary amine

Properties

Molecular formula: C₁₇H₁₉N₃
Molar mass: 265.36 g/mol
Exact mass: 265.1579 Da
Melting point: 120–122 °C
Water solubility: 25 g/L
logP: 2.69Crippen estimate
Polar surface area: 27.6 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 5

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
H312 Harmful in contact with skin97.5% of notifiers
H315 Causes skin irritation95% of notifiers
H319 Causes serious eye irritation95% of notifiers
H335 May cause respiratory irritation95% of notifiers

Aggregated from 40 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, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

91-75-8

SMILES

c1ccc(CN(CC2=NCCN2)c2ccccc2)cc1

InChIKey

REYFJDPCWQRWAA-UHFFFAOYSA-N

InChI

InChI=1S/C17H19N3/c1-3-7-15(8-4-1)13-20(14-17-18-11-12-19-17)16-9-5-2-6-10-16/h1-10H,11-14H2,(H,18,19)

Weigh it out

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

Names and synonyms

8 names

1H-Imidazole-2-methanamine, 4,5-dihydro-N-phenyl-N-(phenylmethyl)-
2-Imidazoline, 2-[(N-benzylanilino)methyl]-
4,5-Dihydro-N-phenyl-N-(phenylmethyl)-1H-imidazole-2-methanamine
Allergan A
Antistine
2-[(N-Benzylanilino)methyl]-2-imidazoline
Phenazoline
Analergine

Work with Antazoline

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Antazoline hydrochloride2508-72-7Salt Antazoline phosphate154-68-7Salt

Similar compounds

Tolazoline59-98-357 % similar Tolazoline hydrochloride59-97-253 % similar Dibenzylaniline91-73-650 % similar Ethylbenzylaniline92-59-144 % similar 2-Phenylimidazoline936-49-244 % similar Phentolamine50-60-242 % similar 1-Benzyl-4-phenylpiperazine3074-46-240 % similar Naphazoline835-31-439 % similar

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

Same formula

Acridine orange494-38-2 Mirtazapine61337-67-5 Mirtazapine85650-52-8

Elsewhere

PubChem CAS Common Chemistry NIST WebBook