Methyl 4-iodo-3-nitrobenzoate

Modify Date: 2025-08-26 20:15:12

Methyl 4-iodo-3-nitrobenzoate Structure
Methyl 4-iodo-3-nitrobenzoate structure
Common Name Methyl 4-iodo-3-nitrobenzoate
CAS Number 89976-27-2 Molecular Weight 307.042
Density 1.9±0.1 g/cm3 Boiling Point 360.1±32.0 °C at 760 mmHg
Molecular Formula C8H6INO4 Melting Point 103-105ºC
MSDS N/A Flash Point 171.6±25.1 °C

 Names

Name Methyl 4-iodo-3-nitrobenzoate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.9±0.1 g/cm3
Boiling Point 360.1±32.0 °C at 760 mmHg
Melting Point 103-105ºC
Molecular Formula C8H6INO4
Molecular Weight 307.042
Flash Point 171.6±25.1 °C
Exact Mass 306.934143
PSA 72.12000
LogP 2.80
Vapour Pressure 0.0±0.8 mmHg at 25°C
Index of Refraction 1.632
Storage condition 2-8°C

 Safety Information

Hazard Codes Xi
Risk Phrases 20/21/22-36/37/38
Safety Phrases 26-37/39
HS Code 2916399090

 Synthetic Route

~86%

Methyl 4-iodo-3-nitrobenzoate Structure

Methyl 4-iodo-3...

CAS#:89976-27-2

Literature: DIVI'S LABORATORIES LIMITED; Divi, Murali Krishna Prasad; Rao, Mysore Aswatha Narayana; Rajuri, Venkataramana Patent: US2013/172618 A1, 2013 ; Location in patent: Paragraph 0025 ;

~69%

Methyl 4-iodo-3-nitrobenzoate Structure

Methyl 4-iodo-3...

CAS#:89976-27-2

Literature: Zhejiang Hisun Pharmaceutical Co., Ltd.; Bai, Hua; Zhao, Xuyang; Gong, Yongxiang; Zhong, Jinqing; Zhu, Qifeng; Liu, Xiaoyu; Liu, Lifei; Zhou, Qixian Patent: US2013/225810 A1, 2013 ; Location in patent: Paragraph 0083; 0084; 0085 ;

~73%

Methyl 4-iodo-3-nitrobenzoate Structure

Methyl 4-iodo-3...

CAS#:89976-27-2

Literature: Kakuta, Hiroki; Yakushiji, Nobumasa; Shinozaki, Ryosuke; Ohsawa, Fuminori; Yamada, Shoya; Ohta, Yui; Kawata, Kohei; Nakayama, Mariko; Hagaya, Manabu; Fujiwara, Chisa; Makishima, Makoto; Uno, Shigeyuki; Tai, Akihiro; Maehara, Ami; Nakayama, Masaru; Oohashi, Toshitaka; Yasui, Hiroyuki; Yoshikawa, Yutaka ACS Medicinal Chemistry Letters, 2012 , vol. 3, # 5 p. 427 - 432

~97%

Methyl 4-iodo-3-nitrobenzoate Structure

Methyl 4-iodo-3...

CAS#:89976-27-2

Literature: DIVI'S LABORATORIES LIMITED; Divi, Murali Krishna Prasad; Rao, Mysore Aswatha Narayana; Rajuri, Venkataramana Patent: US2013/172618 A1, 2013 ; Location in patent: Paragraph 0026 ;

~%

Methyl 4-iodo-3-nitrobenzoate Structure

Methyl 4-iodo-3...

CAS#:89976-27-2

Literature: Tetrahedron Letters, , vol. 38, # 46 p. 7963 - 7966

~%

Methyl 4-iodo-3-nitrobenzoate Structure

Methyl 4-iodo-3...

CAS#:89976-27-2

Literature: ACS Medicinal Chemistry Letters, , vol. 3, # 5 p. 427 - 432

 Customs

HS Code 2916399090
Summary 2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

 Synonyms

Benzoic acid, 4-iodo-3-nitro-, methyl ester
MFCD08064223
Methyl 4-iodo-3-nitrobenzoate
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