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4-Iodoanisole

Catalog Number
ACM696628-1
Product Name
4-Iodoanisole
Structure
CAS
696-62-8
Category
Liquid Crystal (LC) Building Blocks
Synonyms
1-Iodo-4-methoxy-benzen
IUPAC Name
1-iodo-4-methoxybenzene
Molecular Weight
234.03
Molecular Formula
C7H7IO
Canonical SMILES
COC1=CC=C(C=C1)I
InChI
InChI=1S/C7H7IO/c1-9-7-4-2-6(8)3-5-7/h2-5H,1H3
InChI Key
SYSZENVIJHPFNL-UHFFFAOYSA-N
Boiling Point
237 ºC 726 mmHg
Melting Point
50-53 ºC (lit.)
Purity
98%+
Density
1.79 g/ml
Appearance
White to Light yellow to Light orange powder to crystal
Complexity
77
Covalently-Bonded Unit Count
1
EC Number
211-798-7
Exact Mass
233.95416g/mol
Formal Charge
0
Hazard Statements
H315 : Causes skin irritation.H319 : Causes serious eye irritation.
Heavy Atom Count
9
MDL Number
MFCD00001056
MeSH Entry Terms
4-iodoanisole;Izoform
Monoisotopic Mass
233.95416g/mol
NSC Number
60727
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
1
Signal Word
Warning
XLogP3
2.9
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