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1-Chloro-5-iodonaphthalene

HCID 53403296
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Basic information

CAS
159334-77-7
Standard SMILES
Clc1cccc2c(I)cccc12
InChIKey
XLFDQRDVSCTTQN-UHFFFAOYSA-N
Molecular formula
C10H6ClI
Average molar mass
288.51 g/mol
Monoisotopic mass
287.92028

Names & identifiers

Preferred name
1-Chloro-5-iodonaphthalene
IUPAC
1-chloro-5-iodonaphthalene
English name
1-chloro-5-iodonaphthalene
Molecular formula
C10H6ClI
Molecular weight
288.51

Names & synonyms

1-CHLORO-5-IODONAPHTHALENE159334-77-7SCHEMBL24730214DTXSID90695161DB-083993Naphthalene, 1-chloro-5-iodo-

Database identifiers

CAS
159334-77-7
PubChem CID
53403296
DTXSID
DTXSID90695161
Nikkaji
J633.376A

Properties

Computed structural properties

XLogP
4.4
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
0
Heavy atoms
12
Formal charge
0
Complexity
160

Physicochemical properties

Boiling point
341.7 · 341.7±15.0 °C(Predicted)
Density
1.83 · 1.830±0.06 g/cm3(Predicted)

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