4'-Chloroacetophenone
Catalog Number
ACM99912
CAS
99-91-2
IUPAC Name
1-(4-chlorophenyl)ethanone
Molecular Weight
154.59
Molecular Formula
C8H7ClO
Product Information
Canonical SMILES
CC(=O)C1=CC=C(C=C1)Cl
Inchi
InChI=1S/C8H7ClO/c1-6(10)7-2-4-8(9)5-3-7/h2-5H,1H3
InChIKey
BUZYGTVTZYSBCU-UHFFFAOYSA-N
Boiling Point
237 °C
Melting Point
15 °C
Purity
>97.0%(GC)
Density
1.1922 @ 20 °C/4 °C
Solubility
PRACTICALLY INSOL IN WATER; MISCIBLE WITH ALC, ETHER
Appearance
White or Colorless to Light yellow powder to lump to clear liquid
Complexity
125
Hazard Statements
H330 : Fatal if inhaled.H302 : Harmful if swallowed.H315 : Causes skin irritation.H319 : Causes serious eye irritation.
Heavy Atom Count
10
MDL Number
MFCD00000624
Precautionary Statements
P501 : Dispose of contents/ container to an approved waste disposal plant.P260 : Do not breathe 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/ eye protection/ face protection.P284 : Wear respiratory 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.P304 + P340 + P310 : IF INHALED: Remove person to fresh air and keep comfortable for breathing. Immediately call a POISON CENTER/doctor.P403 + P233 : Store in a well-ventilated place. Keep container tightly closed.P405 : Store locked up.
Reaxys Registry Number
386014
Refractive Index
1.55
Rotatable Bond Count
1
Signal Word
Danger
Solubility In Water
Insoluble
Specific Gravity
1.19
Monoisotopic Mass
154.018542g/mol
Exact Mass
154.018542g/mol
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