2-Amino-4-nitrobenzonitrile

Modify Date: 2025-09-09 18:27:57

2-Amino-4-nitrobenzonitrile Structure
2-Amino-4-nitrobenzonitrile structure
 Common Name 2-Amino-4-nitrobenzonitrile
CAS Number 87376-25-8 Molecular Weight 163.133
Density 1.4±0.1 g/cm3 Boiling Point 414.1±35.0 °C at 760 mmHg
Molecular Formula C7H5N3O2 Melting Point N/A
MSDS N/A Flash Point 204.3±25.9 °C

 Names

Name 2-Amino-4-nitrobenzonitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.4±0.1 g/cm3
Boiling Point 414.1±35.0 °C at 760 mmHg
Molecular Formula C7H5N3O2
Molecular Weight 163.133
Flash Point 204.3±25.9 °C
Exact Mass 163.038177
PSA 95.63000
LogP 1.64
Vapour Pressure 0.0±1.0 mmHg at 25°C
Index of Refraction 1.627
InChIKey WLKYODIBWNIWDK-UHFFFAOYSA-N
SMILES N#Cc1ccc([N+](=O)[O-])cc1N
Storage condition 2-8°C

 Safety Information

Hazard Codes T
Risk Phrases R20/21/22
Safety Phrases 26-36/37/39
RIDADR UN 3439
HS Code 2926909090

 Synthetic Route

2-Bromo-5-nitroaniline structure

2-Bromo-5-nitro...

CAS#:10403-47-1

~67%

2-Amino-4-nitrobenzonitrile Structure

2-Amino-4-nitro...

CAS#:87376-25-8

Literature: SmithKline Beecham Corporation Patent: US6300325 B1, 2001 ;
2,4-dinitrobenzonitrile structure

2,4-dinitrobenz...

CAS#:4110-33-2

~0%

2-Amino-4-nitrobenzonitrile Structure

2-Amino-4-nitro...

CAS#:87376-25-8

4-amino-2-nitrobenzonitrile structure

4-amino-2-nitro...

CAS#:72115-07-2

Literature: Kopeikin, V. A.; Kopeikin, V. V.; Mironov, G. S.; Musabekov, Yu. Yu.; Ustinov, V. A. Journal of Organic Chemistry USSR (English Translation), 1983 , vol. 19, # 7 p. 1401 - 1402 Zhurnal Organicheskoi Khimii, 1983 , vol. 19, # 7 p. 1555 - 1556
2-Amino-4-nitrobenzamide structure

2-Amino-4-nitro...

CAS#:31930-18-4

~89%

2-Amino-4-nitrobenzonitrile Structure

2-Amino-4-nitro...

CAS#:87376-25-8

Literature: Rampa, Angela; Bisi, Alessandra; Belluti, Federica; Gobbi, Silvia; Valenti, Piero; Andrisano, Vincenza; Cavrini, Vanni; Cavalli, Andrea; Recanatini, Maurizio Bioorganic and Medicinal Chemistry, 2000 , vol. 8, # 3 p. 497 - 506
2-Amino-4-nitrobenzoic acid structure

2-Amino-4-nitro...

CAS#:619-17-0

~%

2-Amino-4-nitrobenzonitrile Structure

2-Amino-4-nitro...

CAS#:87376-25-8

Literature: Bioorganic and Medicinal Chemistry, , vol. 8, # 3 p. 497 - 506
2-amino-4-nitrobenzoyl chloride structure

2-amino-4-nitro...

CAS#:62242-95-9

~%

2-Amino-4-nitrobenzonitrile Structure

2-Amino-4-nitro...

CAS#:87376-25-8

Literature: Bioorganic and Medicinal Chemistry, , vol. 8, # 3 p. 497 - 506

 Customs

HS Code 2926909090
Summary HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

 Synonyms

2-Amino-4-nitrobenzonitrile
Benzonitrile, 2-amino-4-nitro-
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