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2-Nitropyrene

2-Nitropyrene structure

CAS No:
789-07-1
Formula:
C16H9NO2
Chemical Name:
2-Nitropyrene
Synonyms:
Pyrene,2-nitro-;2-Nitropyrene

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Description

2-Nitropyrene is a member of pyrenes.

2-Nitropyrene Basic Attributes

Molecular Weight：

247.253

Exact Mass：

247.25

UNII：

GI0F8R15CU

DSSTox ID：

DTXSID30229368

Characteristics

PSA：

45.8

XLogP3：

5.01540

Density：

1.422g/cm3

Melting Point：

201.0-202.5 °C

Boiling Point：

455.7ºC at 760 mmHg

Flash Point：

230.3ºC

Refractive Index：

1.87

Drug Information

Metabolism/Metabolites：

2-nitropyrene has known human metabolites that include 2-aminopyrene.

MeSH Entry Terms：

2-nitropyrene

Computed Properties

Molecular Weight:247.25
XLogP3:4.9
Hydrogen Bond Acceptor Count:2
Exact Mass:247.063328530
Monoisotopic Mass:247.063328530
Topological Polar Surface Area:45.8
Heavy Atom Count:19
Complexity:351
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-Nitropyrene

Description
Basic Attributes
Characteristics
Drug Information
Computed Properties

2-Nitropyrene

SDS

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