2-Chloro-4-iodo-3-methylbenzonitrile

HCID 16731995
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Basic information

Standard SMILES
Cc1c(I)ccc(C#N)c1Cl
InChIKey
DKZCIZKYGIQEFY-UHFFFAOYSA-N
Molecular formula
C8H5ClIN
Average molar mass
277.49 g/mol

Names & identifiers

Preferred name
2-Chloro-4-iodo-3-methylbenzonitrile
IUPAC
2-chloro-4-iodo-3-methylbenzonitrile

Names & synonyms

2-Chloro-4-iodo-3-methylbenzonitrile757247-75-9Benzonitrile, 2-chloro-4-iodo-3-methyl-MFCD131920542-chloro-4-iodo-3-methyl-benzonitrileSCHEMBL974487WLZ4463DKZCIZKYGIQEFY-UHFFFAOYSA-NMFCD28987736BS-45226SY244934DB-355656
Show more names
CS-0197415P16642F633870

Database identifiers

PubChem CID
16731995

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
23.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
0
Heavy atoms
11

Related reactions

39 records
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Compound notes

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