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Structure

MORDANT BROWN 4

CAS
6247-27-4
Catalog Number
ACM6247274
Category
Acid Dyes
Molecular Weight
332.271580 [g/mol]
Molecular Formula
C13H12N6O5

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Specification

Synonyms
EINECS 228-362-7, CID5940436, 2-(4,6-Diamino-m-tolylazo)-4,6-dinitrophenol, 6247-27-4
IUPAC Name
(6E)-6-[(2,4-diamino-5-methylphenyl)hydrazinylidene]-2,4-dinitrocyclohexa-2,4-dien-1-one
Canonical SMILES
CC1=CC(=C(C=C1N)N)NN=C2C=C(C=C(C2=O)[N+](=O)[O-])[N+](=O)[O-]
InChI Key
QCEPNSOGSWJPGP-GZTJUZNOSA-N
Boiling Point
596.162ºC at 760 mmHg
Flash Point
314.348ºC
Density
1.704g/cm³
EC Number
228-362-7
Exact Mass
332.08700
H-Bond Acceptor
9
H-Bond Donor
3
What is the molecular formula of MORDANT BROWN 4?

The molecular formula of MORDANT BROWN 4 is C13H12N6O5.

When was MORDANT BROWN 4 first created?

MORDANT BROWN 4 was first created on September 11, 2005.

What is the molecular weight of MORDANT BROWN 4?

The molecular weight of MORDANT BROWN 4 is 332.27 g/mol.

What is the IUPAC name of MORDANT BROWN 4?

The IUPAC name of MORDANT BROWN 4 is 2-[(2,4-diamino-5-methylphenyl)diazenyl]-4,6-dinitrophenol.

What is the CAS number of MORDANT BROWN 4?

The CAS number of MORDANT BROWN 4 is 6247-27-4.

What is the InChIKey of MORDANT BROWN 4?

The InChIKey of MORDANT BROWN 4 is ZQOQTVZVXAHHAW-UHFFFAOYSA-N.

How many hydrogen bond donor counts does MORDANT BROWN 4 have?

MORDANT BROWN 4 has 3 hydrogen bond donor counts.

What is the XLogP3-AA value of MORDANT BROWN 4?

The XLogP3-AA value of MORDANT BROWN 4 is 2.6.

How many hydrogen bond acceptor counts does MORDANT BROWN 4 have?

MORDANT BROWN 4 has 9 hydrogen bond acceptor counts.

Is MORDANT BROWN 4 a canonicalized compound?

Yes, MORDANT BROWN 4 is a canonicalized compound.

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