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3-[2-[(4-azaniumylphenyl)sulfanylmethyl]benzoyl]oxypropyl-dimethylazanium;dichloride

3-[2-[(4-azaniumylphenyl)sulfanylmethyl]benzoyl]oxypropyl-dimethylazanium;dichloride structure

CAS No:
73150-36-4
Formula:
C19H26Cl2N2O2S
Chemical Name:
3-[2-[(4-azaniumylphenyl)sulfanylmethyl]benzoyl]oxypropyl-dimethylazanium;dichloride
Synonyms:
VUFB-10667;73150-36-4;3-Dimethylaminopropyl 2-(4-aminophenylthiomethyl)benzoate dihydrochloride monohydrate;2-(((4-Aminophenyl)thio)methyl)benzoic acid 3-(dimethylamino)propyl ester HCl hydrate (1:2:1);Benzoic acid, 2-(((4-aminophenyl)thio)methyl)-, 3-(dimethylamino)propyl ester, hydrochloride,hydrate (1:2:1)

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3-[2-[(4-azaniumylphenyl)sulfanylmethyl]benzoyl]oxypropyl-dimethylazanium;dichloride Basic Attributes

Molecular Weight：

417.4 g/mol

Exact Mass：

416.1092046 g/mol

Characteristics

PSA：

83.7 Å²

Computed Properties

Molecular Weight:417.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:9
Exact Mass:416.1092046
Monoisotopic Mass:416.1092046
Topological Polar Surface Area:83.7
Heavy Atom Count:26
Complexity:370
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes

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Guide of 3-[2-[(4-azaniumylphenyl)sulfanylmethyl]benzoyl]oxypropyl-dimethylazanium;dichloride

Basic Attributes
Characteristics
Computed Properties

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