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3-Nitrofluoranthene

3-Nitrofluoranthene structure

CAS No:
892-21-7
Formula:
C16H9NO2
Chemical Name:
3-Nitrofluoranthene
Synonyms:
Fluoranthene,3-nitro-;3-Nitrofluoranthene;4-Nitrofluoranthene;NSC 57468
Categories:
Chemical Reagents > Organic Reagents

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Description

ORANGE POWDER

3-Nitrofluoranthene is a nitronaphthalene.

3-Nitrofluoranthene Basic Attributes

Molecular Weight：

247.25

Exact Mass：

247.25

EC Number：

205-912-4

UNII：

R9796OQK2M

NSC Number：

57468

DSSTox ID：

DTXSID0074976

HScode：

2904209090

Characteristics

PSA：

45.8

XLogP3：

4.91860

Density：

1.422g/cm3

Melting Point：

162-168 °C (decomp)

Boiling Point：

445.5ºC at 760 mmHg

Flash Point：

223.5ºC

Refractive Index：

1.87

Water Solubility：

7.89e-08 M

Storage Conditions：

2-8°C

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

safety instructions：

24/25

RTECS Number：

LL4750000

Precautionary statement(s)：

P201, P202, P281, P308+P313, P405, P501

Hazard Statements：

H341

GHS Classification：

|Warning|H341 (100%): Suspected of causing genetic defects [Warning Germ cell mutagenicity]|P201, P202, P281, P308+P313, P405, and P501|Aggregated GHS information provided by 12 companies from 1 notifications to the ECHA C&L Inventory.

Drug Information

MeSH：

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. (See all compounds classified as Mutagens.)|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. (See all compounds classified as Carcinogens.)

MeSH Entry Terms：

3-nitrofluoranthene

Computed Properties

Molecular Weight:247.25
XLogP3:4.7
Hydrogen Bond Acceptor Count:2
Exact Mass:247.063328530
Monoisotopic Mass:247.063328530
Topological Polar Surface Area:45.8
Heavy Atom Count:19
Complexity:377
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes