4'-Butoxybenzylidene-4-cyanoaniline
Catalog Number
ACM36405171-1
CAS
36405-17-1
IUPAC Name
4-[(4-butoxyphenyl)methylideneamino]benzonitrile
Synonyms
4-(4-Butoxybenzylideneamino)benzonitrile
Molecular Weight
278.36
Molecular Formula
C18H18N2O
Product Information
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
Condition to avoid
Heat Sensitive
Exact Mass
278.141913g/mol
Hazard Statements
H302 : Harmful if swallowed.H315 : Causes skin irritation.H319 : Causes serious eye irritation.
Heavy Atom Count
21
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.
Reaxys Registry Number
3035478
Rotatable Bond Count
6
Signal Word
Warning
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