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(2S,10S)-15-benzyl-15-azoniatetracyclo[10.2.1.02,10.04,9]pentadeca-4,6,8-triene;4-methylbenzenesulfonate

(2S,10S)-15-benzyl-15-azoniatetracyclo[10.2.1.02,10.04,9]pentadeca-4,6,8-triene;4-methylbenzenesulfonate structure

CAS No:
53758-10-4
Formula:
C28H31NO3S
Chemical Name:
(2S,10S)-15-benzyl-15-azoniatetracyclo[10.2.1.02,10.04,9]pentadeca-4,6,8-triene;4-methylbenzenesulfonate
Synonyms:
Benz(a)azulen-6,9-imine, 4b,5,6,7,8,9,9a,10-octahydro-11-benzyl-, (4-beta-S-(4b-alpha,6-beta,9-beta,9a-alpha))-, p-tolylsulfonate

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(2S,10S)-15-benzyl-15-azoniatetracyclo[10.2.1.02,10.04,9]pentadeca-4,6,8-triene;4-methylbenzenesulfonate Basic Attributes

Molecular Weight：

461.6 g/mol

Exact Mass：

461.20246502 g/mol

Characteristics

PSA：

70 Å²

Computed Properties

Molecular Weight:461.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:461.20246502
Monoisotopic Mass:461.20246502
Topological Polar Surface Area:70
Heavy Atom Count:33
Complexity:592
Defined Atom Stereocenter Count:2
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Guide of (2S,10S)-15-benzyl-15-azoniatetracyclo[10.2.1.02,10.04,9]pentadeca-4,6,8-triene;4-methylbenzenesulfonate

Basic Attributes
Characteristics
Computed Properties

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