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1-Chloro-2,5-diethoxy-4-nitrobenzene

HCID 66675
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
91-43-0
Standard SMILES
CCOc1cc([N+](=O)[O-])c(OCC)cc1Cl
InChIKey
HWLDAZMGMQYWGW-UHFFFAOYSA-N
Molecular formula
C10H12ClNO4
Average molar mass
245.66 g/mol
Monoisotopic mass
245.0454856

Names & identifiers

Preferred name
1-Chloro-2,5-diethoxy-4-nitrobenzene
IUPAC
1-chloro-2,5-diethoxy-4-nitrobenzene
English name
1-CHLORO-2,5-DIETHOXY-4-NITROBENZENE
Molecular formula
C10H12ClNO4
Molecular weight
245.66

Names & synonyms

1-Chloro-2,5-diethoxy-4-nitrobenzene91-43-05-Chloro-2-nitro-p-diethoxybenzeneBenzene, 1-chloro-2,5-diethoxy-4-nitro-UNII-S410LLV7AFS410LLV7AF2,5-Diethoxy-4-ChloronitrobenzeneEINECS 202-067-3NSC 60284NSC-60284DTXSID00447391-NITRO-2,5-DIETHOXY-4-CHLOROBENZENE
Show more names
1-Chlor-2,5-diethoxy-4-nitrobenzol2,5-DIETHOXY-4-CHLORO NITROBENZENE1-chloro-2,5-diethoxy-4-nitro-benzen2,5-Diethoxy-4-chloro-1-nitrobenzene2-Chloro-5-nitrohydroquinone diethyl ether
RefChem:75333DTXCID8024739202-067-32,5-Diethoxy-4-nitrochlorobenzeneNSC60284MFCD000245781-chloro-2,5-diethoxy-4-nitro-benzene4-CHLORO-2,5-DIETHOXYNITROBENZENE

Database identifiers

CAS
91-43-0
PubChem CID
66675
DTXSID
DTXSID0044739
UNII
S410LLV7AF
EC Number
202-067-3
Nikkaji

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
64.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
16
Formal charge
0
Complexity
233

Physicochemical properties

FDA UNII
410 LLV7AF · S410LLV7AF
EPA Substance Registry System
2 · 2,5-Diethoxy-4-nitrochlorobenzene (91-43-0)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
319 · H319
Precautionary statements
264 · P264-P280-P305+P351+P338-P337+P313P
TSCA
TSCA listed

Safety & regulation

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

GHS classification

GHS Classification · 4 items

Warning

H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesEye Irrit. 2 (100%)

Safety data

tsca
TSCA listed
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H319
Precautionary statements
P264-P280-P305+P351+P338-P337+P313P

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationBenzene, 1-chloro-2,5-diethoxy-4-nitro-: INACTIVE

Suppliers5 total

Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
常州合晶化工有限公司85528066 13775048983 · [email protected]
重庆卡兰医药有限公司[email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
J60.216G