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4-Iodobenzoic Acid

Catalog Number
ACM619589
Product Name
4-Iodobenzoic Acid
Structure
CAS
619-58-9
Category
Liquid Crystal (LC) Building Blocks
IUPAC Name
4-iodobenzoic acid
Molecular Weight
248.02
Molecular Formula
C7H5IO2
Canonical SMILES
C1=CC(=CC=C1C(=O)O)I
InChI
InChI=1S/C7H5IO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,(H,9,10)
InChI Key
GHICCUXQJBDNRN-UHFFFAOYSA-N
Purity
>98.0%(GC)(T)
Appearance
White to Light yellow to Light orange powder to crystal
Complexity
128
Covalently-Bonded Unit Count
1
EC Number
210-603-2
Exact Mass
247.93343g/mol
Formal Charge
0
Hazard Statements
H315 : Causes skin irritation.H319 : Causes serious eye irritation.
Heavy Atom Count
10
MDL Number
MFCD00002533
Monoisotopic Mass
247.93343g/mol
NSC Number
3773
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
UNII
IPO4LYQ1EN
XLogP3
3
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