2-Chloro-4-nitro-1-phenoxybenzene

HCID 92603
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Basic information

CAS
56966-69-9
Standard SMILES
O=[N+]([O-])c1ccc(Oc2ccccc2)c(Cl)c1
InChIKey
ZIDYALDTDUSPFJ-UHFFFAOYSA-N
Molecular formula
C12H8ClNO3
Average molar mass
249.65 g/mol
Monoisotopic mass
249.0192708

Names & identifiers

Preferred name
2-Chloro-4-nitro-1-phenoxybenzene
IUPAC
2-chloro-4-nitro-1-phenoxybenzene
English name
2-chloro-4-nitro-1-phenoxybenzene
Molecular formula
C12H8ClNO3
Molecular weight
249.65

Names & synonyms

2-Chloro-4-nitro-1-phenoxybenzene56966-69-92-Chloro-4-nitrodiphenyl etherUNII-FD9701FBBAEINECS 260-482-5FD9701FBBANSC-167597Benzene, 2-chloro-4-nitro-1-phenoxy-DTXSID00205538NSC 167597CHLORO-4-NITROPHENYL ETHER, 2-3-CHLORO-4-PHENOXY-1-NITROBENZENE
Show more names
RefChem:86255DTXCID30128029NSC167597Oprea1_249680SCHEMBL4029870SCHEMBL4720096MFCD00443713AKOS016026028

Database identifiers

CAS
56966-69-9
PubChem CID
92603
DTXSID
DTXSID00205538
UNII
FD9701FBBA
EC Number
260-482-5
Nikkaji
J267.157C

Properties

Computed structural properties

XLogP
4.3
Topological polar surface area
55.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
17

Physicochemical properties

Boiling point
322.8 · 322.8±27.0 °C(Predicted)
Density
1.358 · 1.358±0.06 g/cm3(Predicted)
FDA UNII
9701 FBBA · FD9701FBBA

Chemistry & industry

Suppliers5 total

苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]
山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]
南兴化工（江苏）有限公司0512-66387035 18662433356 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
南京世洲生物科技有限公司17301488900 · [email protected]

Related reactions

2 records
New reaction record

Compound notes

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