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Structure

Dehydroevodiamine

CAS
67909-49-3
Catalog Number
ACM67909493
Category
Other Products
Molecular Weight
301.3
Molecular Formula
C19H15N3O

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Specification

Synonyms
8,13-Dihydro-14-methyl-5-oxoindolo[2',3':3,4]pyrido[2,1-b]quinazolinium inner salt
InChI
InChI=1S/C19H15N3O/c1-21-16-9-5-3-7-14(16)19(23)22-11-10-13-12-6-2-4-8-15(12)20-17(13)18(21)22/h2-9H,10-11H2,1H3
InChI Key
VXHNSVKJHXSKKM-UHFFFAOYSA-N
Melting Point
190-192 °C
Complexity
753
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
0
Exact Mass
301.12151211
Heavy Atom Count
23
Hydrogen Bond Acceptor Count
3
Hydrogen Bond Donor Count
0
Monoisotopic Mass
301.12151211
Physical State
Solid
Rotatable Bond Count
0
Topological Polar Surface Area
35.9 Ų
What is the molecular formula of dehydroevodiamine?

The molecular formula of dehydroevodiamine is C19H15N3O.

What are the synonyms of dehydroevodiamine?

The synonyms of dehydroevodiamine are 14-Methyl-5-oxo-7,8-dihydro-5H-indolo[2',3':3,4]pyrido[2,1-b]quinazolin-14-ium-13-ide and Evodiamine, dehydro-.

What is the molecular weight of dehydroevodiamine?

The molecular weight of dehydroevodiamine is 301.3 g/mol.

When was dehydroevodiamine created in PubChem?

Dehydroevodiamine was created in PubChem on October 25, 2006.

When was dehydroevodiamine last modified in PubChem?

Dehydroevodiamine was last modified in PubChem on December 30, 2023.

What is the IUPAC name of dehydroevodiamine?

The IUPAC name of dehydroevodiamine is 21-methyl-3,13,21-triazapentacyclo[11.8.0.0 2,10 .0 4,9 .0 15,20 ]henicosa-1,3,5,7,9,15,17,19-octaen-14-one.

What is the InChI of dehydroevodiamine?

The InChI of dehydroevodiamine is InChI=1S/C19H15N3O/c1-21-16-9-5-3-7-14(16)19(23)22-11-10-13-12-6-2-4-8-15(12)20-17(13)18(21)22/h2-9H,10-11H2,1H3.

What is the InChIKey of dehydroevodiamine?

The InChIKey of dehydroevodiamine is VXHNSVKJHXSKKM-UHFFFAOYSA-N.

What is the canonical SMILES of dehydroevodiamine?

The canonical SMILES of dehydroevodiamine is CN1C2=CC=CC=C2C(=O)N3C1=C4C(=C5C=CC=CC5=N4)CC3.

What is the CAS number of dehydroevodiamine?

The CAS number of dehydroevodiamine is 67909-49-3.

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