5-Nitro-1,3-dihydro-2H-benzimidazol-2-one

CAS

93-84-5

Catalog Number

ACM93845

Category

Other Products

Molecular Weight

179.13

Molecular Formula

C₇H₅N₃O₃

MSDS COA Spec Sheet

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Specification

Synonyms

5-Nitro-2-benzimidazolinone, 5-Nitrobenzimidazol-2-one, 2-Hydroxy-5-nitrobenzimidazole, 5-Nitro-2(3H)-benzimidazolone, 2-Benzimidazolinone, 5-nitro-, Oprea1_144876, Oprea1_224100, Oprea1_672306, NSC10380, 558478_ALDRICH, AIDS020317, AIDS-020317, NRB02882, EINECS 202-282-2, NSC 10380, RJC 00810, STK389132, ZINC00173832, 2-Benzimidazolinone, 5-nitro- (8CI), CID3725611

IUPAC Name

5-nitro-1,3-dihydrobenzimidazol-2-one

Canonical SMILES

C1=CC2=C(C=C1[N+](=O)[O-])NC(=O)N2

InChI Key

DLJZIPVEVJOKHB-UHFFFAOYSA-N

Boiling Point

203ºCat 760 mmHg

Melting Point

>300ºC(lit.)

Flash Point

76.5ºC

Density

1.506 g/cm³

Appearance

Yellow to brown powder

EC Number

202-282-2

Exact Mass

179.03300

H-Bond Acceptor

H-Bond Donor

Packing Group

III

Safety Description

S22-S36/37

WGK Germany

What is the chemical formula of 5-Nitro-1,3-dihydro-2H-benzimidazol-2-one?

The chemical formula of 5-Nitro-1,3-dihydro-2H-benzimidazol-2-one is C7H5N3O3.

How is the molecular weight of 5-Nitro-1,3-dihydro-2H-benzimidazol-2-one calculated?

The molecular weight of 5-Nitro-1,3-dihydro-2H-benzimidazol-2-one is 179.13 g/mol.

What are some synonyms for 5-Nitro-1,3-dihydro-2H-benzimidazol-2-one?

Some synonyms for 5-Nitro-1,3-dihydro-2H-benzimidazol-2-one include 5-Nitro-2-benzimidazolinone and 5-Nitro-1,3-dihydrobenzimidazol-2-one.

When was 5-Nitro-1,3-dihydro-2H-benzimidazol-2-one first created?

5-Nitro-1,3-dihydro-2H-benzimidazol-2-one was first created on March 26, 2005.

What is the InChIKey of 5-Nitro-1,3-dihydro-2H-benzimidazol-2-one?

The InChIKey of 5-Nitro-1,3-dihydro-2H-benzimidazol-2-one is DLJZIPVEVJOKHB-UHFFFAOYSA-N.

How many hydrogen bond donor counts does 5-Nitro-1,3-dihydro-2H-benzimidazol-2-one have?

5-Nitro-1,3-dihydro-2H-benzimidazol-2-one has 2 hydrogen bond donor counts.

What is the XLogP3-AA value of 5-Nitro-1,3-dihydro-2H-benzimidazol-2-one?

The XLogP3-AA value of 5-Nitro-1,3-dihydro-2H-benzimidazol-2-one is 0.4.

What is the topological polar surface area of 5-Nitro-1,3-dihydro-2H-benzimidazol-2-one?

The topological polar surface area of 5-Nitro-1,3-dihydro-2H-benzimidazol-2-one is 87?2.

How many rotatable bond counts does 5-Nitro-1,3-dihydro-2H-benzimidazol-2-one have?

5-Nitro-1,3-dihydro-2H-benzimidazol-2-one has 0 rotatable bond counts.

What is the NSC Number of 5-Nitro-1,3-dihydro-2H-benzimidazol-2-one?

The NSC Number of 5-Nitro-1,3-dihydro-2H-benzimidazol-2-one is 10380.