CAS 36405-17-1 4'-Butoxybenzylidene-4-cyanoaniline

NAVIGATION

4'-Butoxybenzylidene-4-cyanoaniline

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Catalog Number

ACM36405171-1

CAS Number

36405-17-1

Product Name

4'-Butoxybenzylidene-4-cyanoaniline

Structure

Category

Liquid Crystal (LC) Building Blocks; Liquid Crystal (LC) Materials

Synonyms

4-(4-Butoxybenzylideneamino)benzonitrile

IUPAC Name

4-[(4-butoxyphenyl)methylideneamino]benzonitrile

Molecular Weight

278.36

Molecular Formula

C18H18N2O

Canonical SMILES

CCCCOC1=CC=C(C=C1)C=NC2=CC=C(C=C2)C#N

InChI

InChI=1S/C18H18N2O/c1-2-3-12-21-18-10-6-16(7-11-18)14-20-17-8-4-15(13-19)5-9-17/h4-11,14H,2-3,12H2,1H3

InChI Key

JWLPZJPDDBBWQD-UHFFFAOYSA-N

Melting Point

120 °C

Purity

98%+

Appearance

White to Yellow powder to crystal

Storage

Sealed in dry. Room temperature.

Complexity

355

Covalently-Bonded Unit Count

EC Number

253-018-8

Exact Mass

278.141913g/mol

Formal Charge

Hazard Statements

H302 : Harmful if swallowed.H315 : Causes skin irritation.H319 : Causes serious eye irritation.

Heavy Atom Count

MDL Number

MFCD00063742

Monoisotopic Mass

278.141913g/mol

Precautionary Statements

P501 : Dispose of contents/ container to an approved waste disposal plant.P270 : Do not eat, drink or smoke when using this product.P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.P301 + P312 + P330 : IF SWALLOWED: Call a POISON CENTER/doctor if you feel unwell. Rinse mouth.

Rotatable Bond Count

Signal Word

Warning

XLogP3

4.2

MSDS

Download MSDS

COA

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Spec Sheet

Download Spec Sheet

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