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7-Methoxy-2-nitronaphtho(2,1-b)furan

HCID 53424
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Basic information

CAS
75965-74-1
Standard SMILES
COc1ccc2c(ccc3oc([N+](=O)[O-])cc32)c1
InChIKey
BRRIJZQYTOFDAF-UHFFFAOYSA-N
Molecular formula
C13H9NO4
Average molar mass
243.21 g/mol
Monoisotopic mass
243.05315777

Overview

structure given in first source

Names & identifiers

Preferred name
7-Methoxy-2-nitronaphtho(2,1-b)furan
IUPAC
7-methoxy-2-nitrobenzo[e][1]benzofuran

Names & synonyms

2-Nitro-7-methoxynaphtho[2,1-b]furan75965-74-12-nitro-7-methoxynaphtho(2-1b)furan7-methoxy-2-nitronaphtho[2,1-b]furan7-Methoxy-2-nitronaphtho(2,1-b)furan2-Nitro-7-methoxynaphtho(2,1-b)furanR-7000NSC-329223NAPHTHO(2,1-b)FURAN, 7-METHOXY-2-NITRO-JC755LAD2MDTXSID80226862Naphtho[2,1-b]furan, 7-methoxy-2-nitro-
Show more names
RefChem:88693DTXCID10149353681-943-07-methoxy-2-nitrobenzo[e][1]benzofuranR 7000CHEMBL7645NSC3292237-Methoxy-2-nitro-naphtho[2,1-b]furan

Database identifiers

CAS
75965-74-1
PubChem CID
53424
DTXSID
DTXSID80226862
ChEMBL
CHEMBL7645
UNII
JC755LAD2M
EC Number
681-943-0
Nikkaji
J23.703E

Properties

Computed structural properties

XLogP
3.7
Topological polar surface area
68.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
1
Heavy atoms
18
Formal charge
0
Complexity
329

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

H341 (100%): Suspected of causing genetic defects [Warning Germ cell mutagenicity]

P203, P280, P318, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 12 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesMuta. 2 (100%)

Chemistry & industry

Pharmacology

MeSH Pharmacological Classification · 3 items

Substances that inhibit or prevent the proliferation of NEOPLASMS.

Substances that increase the risk of NEOPLASMS in humans or animals. Both genotoxic chemicals, which affect DNA directly, and nongenotoxic chemicals, which induce neoplasms by other mechanism, are included.

Chemical agents that increase the rate of genetic mutation by interfering with the function of nucleic acids. A clastogen is a specific mutagen that causes breaks in chromosomes.

Related reactions

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Compound notes

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