CAS 51128-24-6 4-Butoxyphenyl 4-Pentylbenzoate

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4-Butoxyphenyl 4-Pentylbenzoate

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Catalog Number

ACM51128246-1

Product Name

4-Butoxyphenyl 4-Pentylbenzoate

Structure

CAS

51128-24-6

Category

Liquid Crystal (LC) Building Blocks

Synonyms

4-Amylbenzoic Acid 4-Butoxyphenyl Ester

IUPAC Name

(4-butoxyphenyl) 4-pentylbenzoate

Molecular Weight

340.46

Molecular Formula

C22H28O3

Canonical SMILES

CCCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)OCCCC

InChI

InChI=1S/C22H28O3/c1-3-5-7-8-18-9-11-19(12-10-18)22(23)25-21-15-13-20(14-16-21)24-17-6-4-2/h9-16H,3-8,17H2,1-2H3

InChI Key

LEJYVZMFIRFBCQ-UHFFFAOYSA-N

Boiling Point

467.3±38.0 °C

Melting Point

49 °C

Purity

99%+

Appearance

White to Almost white powder to crystal

Storage

Room temperature.

Complexity

352

Covalently-Bonded Unit Count

Exact Mass

340.203845g/mol

Formal Charge

Hazard Statements

H302 + H312 + H332 : Harmful if swallowed, in contact with skin or if inhaled.H315 : Causes skin irritation.H319 : Causes serious eye irritation.

Heavy Atom Count

MDL Number

MFCD00059435

Monoisotopic Mass

340.203845g/mol

Precautionary Statements

P501 : Dispose of contents/ container to an approved waste disposal plant.P261 : Avoid breathing dust/ fume/ gas/ mist/ vapors/ spray.P270 : Do not eat, drink or smoke when using this product.P271 : Use only outdoors or in a well-ventilated area.P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ protective clothing/ 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.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.P302 + P352 + P312 : IF ON SKIN: Wash with plenty of water.Call a POISON CENTER/doctor if you feel unwell.P304 + P340 + P312 : IF INHALED: Remove person to fresh air and keep comfortable for breathing. Call a POISON CENTER/doctor if you feel unwell.

Rotatable Bond Count

Signal Word

Warning

XLogP3

MSDS

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COA

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Spec Sheet

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