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1-Iodo-3-methoxy-2-nitrobenzene

HCID 178710141
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Basic information

CAS
725266-66-0
Standard SMILES
COc1cccc(I)c1[N+](=O)[O-]
InChIKey
RINUUFLGNUBQLM-UHFFFAOYSA-N
Molecular formula
C7H6INO3
Average molar mass
279.03 g/mol
Monoisotopic mass
278.93924

Names & identifiers

Preferred name
1-Iodo-3-methoxy-2-nitrobenzene
IUPAC
1-iodo-3-methoxy-2-nitrobenzene
English name
1-Iodo-3-methoxy-2-nitrobenzene, 3-Iodo-2-nitrophenyl methyl ether
Molecular formula
C7H6INO3
Molecular weight
279.03

Names & synonyms

1-iodo-3-methoxy-2-nitrobenzene725266-66-03-IODO-2-NITROANISOLEMFCD183979331-Iodo-3-methoxy-2-nitrobenzene, 3-Iodo-2-nitrophenyl methyl ether1-iodo-3-methoxy-2-nitrobenzene,3-iodo-2-nitrophenyl methyl ether3-Iodo-2-nitro anisole1-Iodo-3-methoxy-2-nitro-benzeneSCHEMBL20489366AKOS027322684s11058AS-54512
Show more names
Benzene, 1-iodo-3-methoxy-2-nitro-
SY261147CS-0197390F542370

Database identifiers

CAS
725266-66-0
PubChem CID
44720399

Properties

Computed structural propertiesFilling in

XLogP
2.4
Topological polar surface area
55.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
12
Formal charge
0
Complexity
171

Physicochemical properties

form
crystalline powder
color
Orange
Symbol(GHS)
7 · GHS07,GHS08
Signal word
Danger
Hazard statements
302 · H302+H312+H332-H315-H319-H335-H372
Precautionary statements
260 · P260-P261-P264-P270-P271-P280-P301+P312+P330-P302+P352+P312-P304+P340+P312-P305+P351+P338-P314-P332+P313-P337+P313-P362-P363-P403+P233-P405-P501
HS Code
2909309090 · 2909309090

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

hs_code
2909309090
Signal word
Danger
Symbol(GHS)
GHS07,GHS08
Hazard statements
H302+H312+H332-H315-H319-H335-H372
Precautionary statements
P260-P261-P264-P270-P271-P280-P301+P312+P330-P302+P352+P312-P304+P340+P312-P305+P351+P338-P314-P332+P313-P337+P313-P362-P363-P403+P233-P405-P501

Chemistry & industry

Upstream & downstream products

Downstream products

3-Methoxy-2-Nitro Benzonitrile

Related reactions

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Compound notes

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