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Structure

5-Bromo-6-isothiocyanatoquinoxaline

CAS
134892-46-9
Catalog Number
ACM134892469
Category
Bromine Series
Molecular Weight
266.12
Molecular Formula
C9H4 Br N3 S

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Specification

Synonyms
5-BROMO-6-ISOTHIOCYANATE QUINOXALINE;5-BROMO-6-ISOTHIOCYANATOQUINOXALINE;SALOR-INT L163007-1EA;5-bromo-6-isothiocyanatoquinoxaline 98%;5-Bromo-6-isothiocyanatoquinoxaline ,98%
IUPAC Name
5-bromo-6-isothiocyanatoquinoxaline
Canonical SMILES
C1=CC2=NC=CN=C2C(=C1N=C=S)Br
InChI Key
CRNMXQMOFAYYEX-UHFFFAOYSA-N
Boiling Point
414ºC at 760mmHg
Flash Point
204.2ºC
Density
1.7g/cm³
Appearance
Brown Solid
Exact Mass
264.93100
H-Bond Acceptor
4
H-Bond Donor
0
What is the molecular formula of 5-Bromo-6-isothiocyanatoquinoxaline?

The molecular formula is C9H4BrN3S.

What are some synonyms for 5-Bromo-6-isothiocyanatoquinoxaline?

Some synonyms include 5-bromo-6-isothiocyanatequinoxaline, 134892-46-9, and 5-BROMO-6-ISOTHIOCYANATE QUINOXALINE.

What is the molecular weight of 5-Bromo-6-isothiocyanatoquinoxaline?

The molecular weight is 266.12 g/mol.

When was 5-Bromo-6-isothiocyanatoquinoxaline created?

It was created on September 15, 2005.

What is the IUPAC name of 5-Bromo-6-isothiocyanatoquinoxaline?

The IUPAC name is 5-bromo-6-isothiocyanatoquinoxaline.

What is the InChI of 5-Bromo-6-isothiocyanatoquinoxaline?

The InChI is InChI=1S/C9H4BrN3S/c10-8-6(13-5-14)1-2-7-9(8)12-4-3-11-7/h1-4H.

What is the InChIKey of 5-Bromo-6-isothiocyanatoquinoxaline?

The InChIKey is CRNMXQMOFAYYEX-UHFFFAOYSA-N.

What is the canonical SMILES of 5-Bromo-6-isothiocyanatoquinoxaline?

The canonical SMILES is C1=CC2=NC=CN=C2C(=C1N=C=S)Br.

What is the CAS number of 5-Bromo-6-isothiocyanatoquinoxaline?

The CAS number is 134892-46-9.

What is the topological polar surface area of 5-Bromo-6-isothiocyanatoquinoxaline?

The topological polar surface area is 70.2Ų.

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