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Structure

1-[(2-Aminoethyl)amino]anthraquinone,monohydrochloride

CAS
97404-13-2
Catalog Number
ACM97404132
Category
Other Products
Molecular Weight
302.755500 [g/mol]
Molecular Formula
C16H14N2O2.HCl

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Specification

Synonyms
EINECS 306-777-5, 1-((2-Aminoethyl)amino)anthraquinone, monohydrochloride, 97404-13-2
IUPAC Name
1-(2-aminoethylamino)anthracene-9,10-dione hydrochloride
InChI Key
WYTHYWAAQAHLGD-UHFFFAOYSA-N
Boiling Point
535.7ºC at 760mmHg
Flash Point
277.8ºC
Exact Mass
302.08200
H-Bond Acceptor
4
H-Bond Donor
3
What is the molecular formula of 1-[(2-Aminoethyl)amino]anthraquinone, monohydrochloride?

The molecular formula is C16H15ClN2O2.

What is the molecular weight of 1-[(2-Aminoethyl)amino]anthraquinone, monohydrochloride?

The molecular weight is 302.75 g/mol.

What is the IUPAC Name of 1-[(2-Aminoethyl)amino]anthraquinone, monohydrochloride?

The IUPAC Name is 1-(2-aminoethylamino)anthracene-9,10-dione;hydrochloride.

What is the InChIKey of 1-[(2-Aminoethyl)amino]anthraquinone, monohydrochloride?

The InChIKey is WYTHYWAAQAHLGD-UHFFFAOYSA-N.

What is the Canonical SMILES of 1-[(2-Aminoethyl)amino]anthraquinone, monohydrochloride?

The Canonical SMILES is C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)NCCN.Cl.

What is the CAS number of 1-[(2-Aminoethyl)amino]anthraquinone, monohydrochloride?

The CAS number is 97404-13-2.

How many hydrogen bond donor counts are there in 1-[(2-Aminoethyl)amino]anthraquinone, monohydrochloride?

There are 3 hydrogen bond donor counts.

What is the exact mass of 1-[(2-Aminoethyl)amino]anthraquinone, monohydrochloride?

The exact mass is 302.0822054 g/mol.

What is the topological polar surface area of 1-[(2-Aminoethyl)amino]anthraquinone, monohydrochloride?

The topological polar surface area is 72.2?2.

Is the compound canonicalized?

Yes, the compound is canonicalized.

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