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Structure

METHYL 4-IODO-3-METHYLBENZOATE

CAS
5471-81-8
Catalog Number
ACM5471818
Category
Other Products
Molecular Weight
276.07
Molecular Formula
C9H9IO2

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Specification

Synonyms
Methyl 4-Iodo-m-toluate, Methyl 4-Iodo-3-methylbenzoate, NSC28460, MolPort-001-768-751, AIDS018035, 4-Iodo-m-toluic Acid Methyl Ester, AIDS-018035, 4-Iodo-m-toluic acid, methyl ester, CID231757, OR4700, ZINC01646468, 4-Iodo-3-methylbenzoic Acid Methyl Ester, I0601, I01-5781, 5471-81-8
IUPAC Name
methyl 4-iodo-3-methylbenzoate
Canonical SMILES
CC1=C(C=CC(=C1)C(=O)OC)I
InChI Key
HCSGWQGKCVQIRM-UHFFFAOYSA-N
Boiling Point
299ºC at 760 mmHg
Melting Point
59-62ºC
Flash Point
134.6ºC
Density
1.666 g/cm³
Exact Mass
275.96500
H-Bond Acceptor
2
H-Bond Donor
0
Safety Description
S24/25
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