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3-nitrobenzo(a)pyrene

CAS 70021-98-6C20H11NO2MW 297.3

3-nitrobenzo(a)pyrene (CAS 70021-98-6) — formula C20H11NO2, molecular weight 297.3; category organic chemicals.

Product Overview

CAS Number70021-98-6
Molecular FormulaC20H11NO2
Molecular Weight297.3
Melting Point211-212 °C
LogP6.3
CategoryOrganic Chemicals

Technical Profile

What this product is

3-nitrobenzo(a)pyrene is a carbon-based organic compound with CAS registry number 70021-98-6 and molecular formula C20H11NO2 (molecular weight 297.3), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 70021-98-6

Its molecular formula C20H11NO2 comprises 20 C, 11 H, 1 N, 2 O atoms.

Also known as: 3-nitrobenzo(a)pyrene · 3-硝基苯并(a)芘

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of 3-nitrobenzo(a)pyrene?

The CAS registry number of 3-nitrobenzo(a)pyrene is 70021-98-6.

What is the molecular formula and molecular weight of 3-nitrobenzo(a)pyrene?

Molecular formula C20H11NO2, molecular weight 297.3.

What other names is 3-nitrobenzo(a)pyrene known by?

It is also registered under: 3-nitrobenzo(a)pyrene, 3-硝基苯并(a)芘.

Which category does 3-nitrobenzo(a)pyrene belong to?

Category: Organic Chemicals.

PubChem Public Data

Independent reference data for 3-nitrobenzo(a)pyrene (CAS 70021-98-6), compiled from public chemistry databases.

Registry identifiers across databases

CAS 号70021-98-6
PubChem CID50961
分子式C20H11NO2
IUPAC 名称3-nitrobenzo[a]pyrene
UNII(FDA)R4GCL2XE8T

Computed descriptors

Molecular Weight297.3
XLogP36.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass297.078978594
Monoisotopic Mass297.078978594
Topological Polar Surface Area45.8
Heavy Atom Count23

Physicochemical values on record

Melting Point211-212 °C

Synonyms and trade names

3-Nitrobenzo(a)pyrene; 3-Nitrobenz(a)pyrene; 3-nitrobenzo[a]pyrene; 70021-98-6; R4GCL2XE8T; DTXSID30220310; BENZO(a)PYRENE, 3-NITRO-; RefChem:95024; 3-NBaP; DTXCID30142801; CCRIS 2433; BRN 4322790; HSDB 8188; UNII-R4GCL2XE8T; 3-nitrobenzo[pqr]tetraphene; CHEMBL353831

What the public record says

3-硝基苯并(a)芘 · CAS 70021-98-6 · C20H11NO2. UNII R4GCL2XE8T. Melting Point: 211-212 °C.

Source: PubChem / Wikidata; the batch COA governs where values differ.

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