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4'-Decyloxybiphenyl-4-carboxylic Acid

Catalog Number
ACM69367324-1
CAS Number
69367-32-4
Product Name
4'-Decyloxybiphenyl-4-carboxylic Acid
Structure
Category
Liquid Crystal (LC) Building Blocks; Liquid Crystal (LC) Materials
IUPAC Name
4-(4-decoxyphenyl)benzoic acid
Molecular Weight
354.49
Molecular Formula
C23H30O3
Canonical SMILES
CCCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O
InChI
InChI=1S/C23H30O3/c1-2-3-4-5-6-7-8-9-18-26-22-16-14-20(15-17-22)19-10-12-21(13-11-19)23(24)25/h10-17H,2-9,18H2,1H3,(H,24,25)
InChI Key
HQVTYOXUVQQMLD-UHFFFAOYSA-N
Purity
>98.0%(T)(HPLC)
Appearance
White to Almost white powder to crystal
Complexity
366
Covalently-Bonded Unit Count
1
Exact Mass
354.219495g/mol
Formal Charge
0
Hazard Statements
H315 : Causes skin irritation.H319 : Causes serious eye irritation.
Heavy Atom Count
26
MDL Number
MFCD00130126
Monoisotopic Mass
354.219495g/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
12
Signal Word
Warning
XLogP3
7.7
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