2-Iodotoluene

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Catalog Number
ACM615372
Product Name
2-Iodotoluene
CAS
615-37-2
Category
Aryl
Synonyms
Toluene,o-iodo-
IUPAC Name
1-iodo-2-methylbenzene
Molecular Weight
218.03
Molecular Formula
C7H7I
Canonical SMILES
CC1=CC=CC=C1I
InChI
InChI=1S/C7H7I/c1-6-4-2-3-5-7(6)8/h2-5H,1H3
InChI Key
RINOYHWVBUKAQE-UHFFFAOYSA-N
Boiling Point
211 °C
Melting Point
11.27 °C
Density
1.713 g/ml
Appearance
Clear yellow to orange liquid
Complexity
70.8
Covalently-Bonded Unit Count
1
EC Number
210-422-9
Exact Mass
217.95925g/mol
Formal Charge
0
Hazard Statements
H314
H-Bond Acceptor
0
H-Bond Donor
0
Heavy Atom Count
8
Monoisotopic Mass
217.95925g/mol
NSC Number
3774
RIDADR
UN 3261 8 / PGII
Rotatable Bond Count
0
Symbol
GHS05
UNII
8OK4H85T07
Vapor Pressure
0.45 mmHg
XLogP3
2.9
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