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[1-[2-[methyl-[2-[4-(oxoazaniumylmethylidene)pyridin-1-yl]ethyl]amino]ethyl]pyridin-4-ylidene]methyl-oxoazanium,dichloride

[1-[2-[methyl-[2-[4-(oxoazaniumylmethylidene)pyridin-1-yl]ethyl]amino]ethyl]pyridin-4-ylidene]methyl-oxoazanium,dichloride structure

CAS No:
1099-31-6
Formula:
C17H23Cl2N5O2
Chemical Name:
[1-[2-[methyl-[2-[4-(oxoazaniumylmethylidene)pyridin-1-yl]ethyl]amino]ethyl]pyridin-4-ylidene]methyl-oxoazanium,dichloride
Synonyms:
Pyridinium,1,1'-(methyliminodiethylene)bis(4-formyl-,dichloride,dioxime; R 25; [1-[2-[methyl-[2-[4-(oxoazaniumylmethylidene)pyridin-1-yl]ethyl]amino]ethyl]pyridin-4-ylidene]methyl-oxoazanium dichloride;

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[1-[2-[methyl-[2-[4-(oxoazaniumylmethylidene)pyridin-1-yl]ethyl]amino]ethyl]pyridin-4-ylidene]methyl-oxoazanium,dichloride Basic Attributes

Molecular Weight：

400.30300

Exact Mass：

399.1228804

Characteristics

PSA：

71.96000

XLogP3：

3.09660

Boiling Point：

446.5ºC

Flash Point：

223.8ºC

Vapor Pressure：

3.64E-08mmHg at 25°C

Computed Properties

Molecular Weight:400.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:399.1228804
Monoisotopic Mass:399.1228804
Topological Polar Surface Area:76.2
Heavy Atom Count:26
Complexity:352
Defined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes

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Guide of [1-[2-[methyl-[2-[4-(oxoazaniumylmethylidene)pyridin-1-yl]ethyl]amino]ethyl]pyridin-4-ylidene]methyl-oxoazanium,dichloride

Basic Attributes
Characteristics
Computed Properties

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