CAS 16833-17-3 Butyl 4-[(4-Methoxybenzylidene)amino]cinnamate

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Butyl 4-[(4-Methoxybenzylidene)amino]cinnamate

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Catalog Number

ACM16833173-1

CAS Number

16833-17-3

Product Name

Butyl 4-[(4-Methoxybenzylidene)amino]cinnamate

Structure

Category

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

Synonyms

4-(p-Anisalamino)cinnamic Acid Butyl Ester

IUPAC Name

butyl (E)-3-[4-[(4-methoxyphenyl)methylideneamino]phenyl]prop-2-enoate

Molecular Weight

337.42

Molecular Formula

C21H23NO3

Canonical SMILES

CCCCOC(=O)/C=C/C1=CC=C(C=C1)N=CC2=CC=C(C=C2)OC

InChI

InChI=1S/C21H23NO3/c1-3-4-15-25-21(23)14-9-17-5-10-19(11-6-17)22-16-18-7-12-20(24-2)13-8-18/h5-14,16H,3-4,15H2,1-2H3/b14-9+,22-16?

InChI Key

CULYZFOOJBHBNM-CIZPVDQASA-N

Melting Point

120 °C

Purity

98%+

Appearance

Light yellow to Yellow to Orange powder to crystal

Storage

Sealed in dry. Room temperature.

Complexity

430

Covalently-Bonded Unit Count

Exact Mass

337.167794g/mol

Formal Charge

Hazard Statements

H315 : Causes skin irritation.H319 : Causes serious eye irritation.

Heavy Atom Count

MDL Number

MFCD00059871

Monoisotopic Mass

337.167794g/mol

Precautionary Statements

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.

Rotatable Bond Count

Signal Word

Warning

XLogP3

4.7

MSDS

Download MSDS

COA

Download COA

Spec Sheet

Download Spec Sheet

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