4-Butoxybenzoic Acid
Catalog Number
ACM1498960-1
CAS
1498-96-0
IUPAC Name
4-butoxybenzoic acid
Synonyms
p -(Butyloxy)benzoic acid,p -Butoxybenzoic acid
Molecular Weight
194.23
Molecular Formula
C11H14O3
Product Information
Canonical SMILES
CCCCOC1=CC=C(C=C1)C(=O)O
Inchi
InChI=1S/C11H14O3/c1-2-3-8-14-10-6-4-9(5-7-10)11(12)13/h4-7H,2-3,8H2,1H3,(H,12,13)
InChIKey
LAUFPZPAKULAGB-UHFFFAOYSA-N
Melting Point
162 °C
Purity
>98.0%(GC)(T)
Appearance
White to Almost white powder to crystal
Complexity
171
Hazard Statements
H315 : Causes skin irritation.H319 : Causes serious eye irritation.
Heavy Atom Count
14
MDL Number
MFCD00002546
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.
Reaxys Registry Number
2208901
Rotatable Bond Count
5
Signal Word
Warning
Monoisotopic Mass
194.094294g/mol
Exact Mass
194.094294g/mol
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