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1-Iodo-3-nitrobenzene

CAS No.
645-00-1
Chemical Name:
1-Iodo-3-nitrobenzene
Synonyms
1-iodo-3-nitro-benzen;Iodo-3-nitrobenz;3-Nitroiodobenzene;M-NITROIODOBENZENE;M-IODONITROBENZENE;3-IODONITROBENZENE;m-Nitrophenyliodide;3-Nitrophenyl iodide;1-IODO-3-NITROBENZENE;3-Nitro-1-iodobenzene
CBNumber:
CB8250221
Molecular Formula:
C6H4INO2
Molecular Weight:
249.01
MDL Number:
MFCD00007218
MOL File:
645-00-1.mol
MSDS File:
SDS
TDS File:
TDS
Last updated:2026-05-28 04:31:47

1-Iodo-3-nitrobenzene Properties

Melting point 36-38 °C (lit.)
Boiling point 280 °C (lit.)
Density 1.9477
Flash point 161 °F
storage temp. Refrigerator (+4°C) + Flammables area
form powder to lump to clear liquid
color Light yellow to Yellow
Water Solubility insoluble
Sensitive Light Sensitive
BRN 1525167
Stability Stable. Highly flammable. Incompatible with strong bases, strong oxidizing agents.
InChI 1S/C6H4INO2/c7-5-2-1-3-6(4-5)8(9)10/h1-4H
InChIKey CBYAZOKPJYBCHE-UHFFFAOYSA-N
SMILES [O-][N+](=O)c1cccc(I)c1
CAS DataBase Reference 645-00-1(CAS DataBase Reference)
FDA UNII F6TCH3TLL9
NIST Chemistry Reference m-Iodonitrobenzene(645-00-1)
EPA Substance Registry System m-Iodonitrobenzene (645-00-1)
UNSPSC Code 12352100
NACRES NA.22

SAFETY

Risk and Safety Statements

Symbol(GHS)  Flame (GHS02)Exclamation Mark (GHS07)
GHS02,GHS07
Signal word  Danger
Hazard statements  H228-H302+H312+H332-H315-H319-H335
Precautionary statements  P210-P280-P301+P312-P302+P352+P312-P304+P340+P312-P305+P351+P338
target organs Respiratory system
PPE Eyeshields, Gloves, type P3 (EN 143) respirator cartridges
Hazard Codes  Xn,F,Xi
Risk Statements  20/21/22-36/37/38-36-33-11
Safety Statements  26-36/37/39-45-16-36
RIDADR  UN 1325 4.1/PG 2
WGK Germany  3
TSCA  TSCA listed
HazardClass  4.1
HS Code  29049090
Storage Class 4.1B - Flammable solid hazardous materials
Hazard Classifications Acute Tox. 4 Dermal
Acute Tox. 4 Inhalation
Acute Tox. 4 Oral
Eye Irrit. 2
Flam. Sol. 1
Skin Irrit. 2
STOT SE 3
Limited Quantities 1.0 Kg (2.2 lbs)
Excepted Quantities Max Inner Pack (30g or 30ml) and Max Outer Pack (500g or 500ml)
NFPA 704
2
2 0

1-Iodo-3-nitrobenzene price More Price(23)

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
Sigma-Aldrich 144495 1-Iodo-3-nitrobenzene 99% 645-00-1 25g $336 2026-04-30 Buy
TCI Chemical I0063 1-Iodo-3-nitrobenzene >98.0%(GC) 645-00-1 25g $101 2026-04-30 Buy
TRC TRC-I715615-5G 1-Iodo-3-nitrobenzene 645-00-1 5g $90 2026-06-03 Buy
TRC TRC-I715615-25G 1-Iodo-3-nitrobenzene 645-00-1 25g $127 2026-06-03 Buy
TRC TRC-I715615-1G 1-Iodo-3-nitrobenzene 645-00-1 1g $72 2026-06-03 Buy
Product number Packaging Price Buy
144495 25g $336 Buy
I0063 25g $101 Buy
TRC-I715615-5G 5g $90 Buy
TRC-I715615-25G 25g $127 Buy
TRC-I715615-1G 1g $72 Buy

1-Iodo-3-nitrobenzene Chemical Properties,Uses,Production

Chemical Properties

yellow to yellow-green powder

Uses

1-Iodo-3-nitrobenzene was used in the synthesis of 5-substituted pyrrolo[3,2-b]pyridine amide and 3′-nitro-4-methylthiobiphenyl. It was used in palladium(0) catalyzed cross-coupling reaction between heteroarylzinc iodide and unsaturated iodide.

Definition

ChEBI: A C-nitro compound that is nitrobenzene bearing an iodine substituent at C-3.

General Description

Monoclinic prisms or tan solid.

1-Iodo-3-nitrobenzene Preparation Products And Raw materials

1-Iodo-3-nitrobenzene Suppliers

Global( 23)Suppliers
Supplier Tel Email Country ProdList Advantage
Shanghai He Huan Chemical Co., Ltd. 021-60345187 13917602471 lzz841106@aliyun.com China 483 58
Shanghai Jizhi Biochemical Technology Co. Ltd. 021-4009004166/18616739031 18616739031 3007523370@qq.com China 40000 58
Dideu Industries Group Limited +8617392712697 1022@dideu.com China 29091 58
CD Chemical Group Limited +86-13651442114 info@codchem.com China 17253 58
Fuxin Pharmaceutical +86-021-021-50872116 contact@fuxinpharm.com China 9976 58
Sanjing New Materials Technology (Taizhou) Co., Ltd. 13852622638 1048979734@qq.com China 778 58
Shanghai Maclean Biochemical Technology Co., LTD 021-50706066 15221275939 shenlinxing@macklin.cn China 29676 58
Shandong Yiren Pharmaceutical Co. LTD 531-87922518 15628888630 1029084569@qq.com China 1455 58
Shanghai Aladdin Biochemical Technology Co.,Ltd. 6206333 13167063860 anhua.mao@aladdin-e.com China 43293 58
Shanghai Baoyang Baoxin Biotechnology Co., LTD 021-56698539 19921169802 bxsw_sh@163.com China 3913 58
3-Nitroiodobenzene Benzene, 1-iodo-3-nitro- m-Nitrophenyliodide 3-IODONITROBENZENE 1-IODO-3-NITROBENZENE M-IODONITROBENZENE M-NITROIODOBENZENE 3-IODONITROBENZENE 97% 1-Iodo-3-nitrobenzene,98% 3-Iodo-1-nitrobenzene 3-Nitro-1-iodobenzene 3-Nitrophenyl iodide 1-Iodo-3-nitrobenzene,99% 3-IODONITROBENZENE / 1-IODO-3-NITROBENZENE Iodo-3-nitrobenz Between the nitro iodobenzene 1-Iodo-3-nitrobenzene> 1-iodo-3-nitro-benzen 645-00-1 IC6H4NO2 HALOGEN Nitro Compounds Nitrogen Compounds Organic Building Blocks Building Blocks Benzene derivates Iodine Compounds Nitro Compounds Nitro Compounds Nitrogen Compounds Organic Building Blocks