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C₁₁H₁₄ClN₅CAS 97404-02-9251.72 g/mol

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Alkene Imine

Properties

Molecular formula: C₁₁H₁₄ClN₅
Molar mass: 251.72 g/mol
Exact mass: 251.0938 Da
logP: 1.19Crippen estimate
Polar surface area: 58.4 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 1

Hazards

Danger

H302 Harmful if swallowed98.5% of notifiers
H312 Harmful in contact with skin27.5% of notifiers
H317 May cause an allergic skin reaction70.5% of notifiers
H318 Causes serious eye damage70.5% of notifiers
H332 Harmful if inhaled27.5% of notifiers
H411 Toxic to aquatic life with long lasting effects67% of notifiers

Aggregated from 200 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P272, P273, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P321, P330, P333+P317, P362+P364, P391, P501

Identifiers

CAS number

97404-02-9

SMILES

Cl.Cn1ccn(C)c1=NN=C1C=CC(=N)C=C1

InChIKey

KEVCVWPVGPWWOI-UHFFFAOYSA-N

InChI

InChI=1S/C11H13N5.ClH/c1-15-7-8-16(2)11(15)14-13-10-5-3-9(12)4-6-10;/h3-8,12H,1-2H3;1H

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Names and synonyms

3 names

1H-Imidazolium, 2-[2-(4-aminophenyl)diazenyl]-1,3-dimethyl-, chloride (1:1)
1H-Imidazolium, 2-[(4-aminophenyl)azo]-1,3-dimethyl-, chloride
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Similar compounds

Pararosaniline569-61-930 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook