2,1,3-Benzoxadiazole,4-nitro-

Modify Date: 2025-08-27 18:15:51

2,1,3-Benzoxadiazole,4-nitro- Structure
2,1,3-Benzoxadiazole,4-nitro- structure
 Common Name 2,1,3-Benzoxadiazole,4-nitro-
CAS Number 16322-19-3 Molecular Weight 165.10600
Density 1.577g/cm3 Boiling Point 301.4ºC at 760mmHg
Molecular Formula C6H3N3O3 Melting Point N/A
MSDS N/A Flash Point 136.1ºC

 Names

Name 4-Nitro-2,1,3-benzoxadiazole
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.577g/cm3
Boiling Point 301.4ºC at 760mmHg
Molecular Formula C6H3N3O3
Molecular Weight 165.10600
Flash Point 136.1ºC
Exact Mass 165.01700
PSA 84.74000
LogP 1.65420
Vapour Pressure 0.00189mmHg at 25°C
Index of Refraction 1.67
InChIKey ZCVAGTPWBAZXAL-UHFFFAOYSA-N
SMILES O=[N+]([O-])c1cccc2nonc12

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DF8029850
CHEMICAL NAME :
Benzofurazan, 4-nitro-
CAS REGISTRY NUMBER :
16322-19-3
BEILSTEIN REFERENCE NO. :
0156239
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C6-H3-N3-O3
MOLECULAR WEIGHT :
165.12
WISWESSER LINE NOTATION :
T56 BNONJ FNW

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

MUTATION DATA

TYPE OF TEST :
DNA inhibition
TEST SYSTEM :
Rodent - mouse Leukocyte
DOSE/DURATION :
3 umol/L
REFERENCE :
CNREA8 Cancer Research. (Public Ledger Building, Suit 816, 6th & Chestnut Sts., Philadelphia, PA 19106) V.1- 1941- Volume(issue)/page/year: 35,3735,1975

 Safety Information

HS Code 2934999090

 Synthetic Route

2,1,3-benzoxadiazole structure

2,1,3-benzoxadiazole

CAS#:273-09-6

~75%

2,1,3-Benzoxadiazole,4-nitro- Structure

2,1,3-Benzoxadi...

CAS#:16322-19-3

Literature: Read, Roger W.; Spear, Robert J.; Norris, William P. Australian Journal of Chemistry, 1983 , vol. 36, # 6 p. 1227 - 1237
Benzofuroxan structure

Benzofuroxan

CAS#:480-96-6

~%

2,1,3-Benzoxadiazole,4-nitro- Structure

2,1,3-Benzoxadi...

CAS#:16322-19-3

Literature: Journal of Organic Chemistry, , vol. 28, p. 1656 - 1662
Benzene,1-azido-2-nitro- structure

Benzene,1-azido...

CAS#:1516-58-1

~%

2,1,3-Benzoxadiazole,4-nitro- Structure

2,1,3-Benzoxadi...

CAS#:16322-19-3

Literature: Journal of Medicinal Chemistry, , vol. 11, # 2 p. 305 - 311
5-nitro-9-oxido-8-oxa-7-aza-9-azoniabicyclo[4.3.0]nona-2,4,6,9-tetraene structure

5-nitro-9-oxido...

CAS#:18771-85-2

~%

2,1,3-Benzoxadiazole,4-nitro- Structure

2,1,3-Benzoxadi...

CAS#:16322-19-3

Literature: Journal of Organic Chemistry, , vol. 28, p. 1656 - 1662
5-methoxy-4-aci-nitro-4,5-dihydro-benzo[1,2,5]oxadiazole, deprotonated form structure

5-methoxy-4-aci...

CAS#:73466-75-8

~%

2,1,3-Benzoxadiazole,4-nitro- Structure

2,1,3-Benzoxadi...

CAS#:16322-19-3

methoxide anion structure

methoxide anion

CAS#:3315-60-4

Literature: Journal of Organic Chemistry, , vol. 45, # 13 p. 2666 - 2672
N/A structure

N/A

CAS#:30124-24-4

~%

2,1,3-Benzoxadiazole,4-nitro- Structure

2,1,3-Benzoxadi...

CAS#:16322-19-3

methoxide anion structure

methoxide anion

CAS#:3315-60-4

Literature: Journal of Organic Chemistry, , vol. 45, # 13 p. 2666 - 2672
2,6-Dinitroaniline structure

2,6-Dinitroaniline

CAS#:606-22-4

~%

2,1,3-Benzoxadiazole,4-nitro- Structure

2,1,3-Benzoxadi...

CAS#:16322-19-3

nitrobenzene structure

nitrobenzene

CAS#:98-95-3

o-Nitrophenol structure

o-Nitrophenol

CAS#:88-75-5

Literature: Journal of Physical Chemistry, , vol. 99, # 23 p. 9593 - 9602

 Customs

HS Code 2934999090
Summary 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Synonyms

4-nitro-2,1,3-benzoxodiazole
4-Nitrobenzofurazane
nitrobenzoxadiazole
7-Nitro-2,1,3-benzoxadiazole
4-Nitro-benz-2,1,3-oxadiazol
7-Nitrobenz-2-oxa-1,3-diazole
7-Nitrobenzofurazane
4-nitrobenzo[c][1,2,5]oxadiazole
7-chloro-4-nitrobenzofurazan
4 nitrobenzofurazan
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