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4-[(Methoxybenzylidene)amino]stilbene

Catalog Number
ACM322413127
Product Name
4-[(Methoxybenzylidene)amino]stilbene
CAS
322413-12-7
Category
Liquid Crystal (LC) Building Blocks
Synonyms
4-(p-Anisalamino)stilbene
IUPAC Name
1-(4-methoxyphenyl)-N-[4-[(E)-2-phenylethenyl]phenyl]methanimine
Molecular Weight
313.4
Molecular Formula
C22H19NO
Canonical SMILES
COC1=CC=C(C=C1)C=NC2=CC=C(C=C2)/C=C/C3=CC=CC=C3
InChI
InChI=1S/C22H19NO/c1-24-22-15-11-20(12-16-22)17-23-21-13-9-19(10-14-21)8-7-18-5-3-2-4-6-18/h2-17H,1H3/b8-7+,23-17?
InChI Key
AMWLHYSTQXHJRQ-QRXNLXSYSA-N
Melting Point
194-247 ºC
Purity
98%+
Appearance
Light yellow to Yellow to Orange powder to crystal
Complexity
394
Covalently-Bonded Unit Count
1
Exact Mass
313.146664g/mol
Formal Charge
0
Hazard Statements
H302 : Harmful if swallowed.H315 : Causes skin irritation.H319 : Causes serious eye irritation.
Heavy Atom Count
24
MDL Number
MFCD00059296
Monoisotopic Mass
313.146664g/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
5
Signal Word
Warning
XLogP3
5.5
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