CAS 625-95-6 3-Iodotoluene - Materials / Alfa Chemistry

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3-Iodotoluene

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Catalog Number

ACM625956

CAS Number

625-95-6

Product Name

3-Iodotoluene

Structure

Category

Liquid Crystal (LC) Materials

Synonyms

3-Methyl-iodobenzene

IUPAC Name

1-iodo-3-methylbenzene

Molecular Weight

218.04

Molecular Formula

C7H7I

Canonical SMILES

CC1=CC(=CC=C1)I

InChI

InChI=1S/C7H7I/c1-6-3-2-4-7(8)5-6/h2-5H,1H3

InChI Key

VLCPISYURGTGLP-UHFFFAOYSA-N

Boiling Point

80-82 ºC 10 mmHg (lit.)

Melting Point

-27 ºC

Purity

98%+

Density

1.698 g/ml

Complexity

70.8

Covalently-Bonded Unit Count

EC Number

210-918-5

Exact Mass

217.95925g/mol

Formal Charge

Hazard Statements

H302-H315-H319-H335

Heavy Atom Count

MeSH Entry Terms

3-iodotoluene;m-iodotoluene;meta-iodotoluene;o-iodotoluene;p-iodotoluene

Monoisotopic Mass

217.95925g/mol

NSC Number

3775

Rotatable Bond Count

UNII

2H574IR35G

XLogP3

3.5

MSDS

Download MSDS

COA

Download COA

Spec Sheet

Download Spec Sheet

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