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4-methylbenzenesulfonic acid;(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl) carbamimidothioate

4-methylbenzenesulfonic acid;(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl) carbamimidothioate structure

CAS No:
6267-49-8
Formula:
C18H28N2O3S2
Chemical Name:
4-methylbenzenesulfonic acid;(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl) carbamimidothioate
Synonyms:
MLS002607889;6267-49-8;NSC34553;CHEMBL1893397;DTXSID90978249;HMS3078K16;NSC-34553;SMR001526651;1,7,7-TRIMETHYLBICYCLO[2.2.1]HEPT-2-YL IMIDOTHIOCARBAMATE 4-METHYLBENZENESULFONATE;4-Methylbenzene-1-sulfonic acid--1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl carbamimidothioate (1/1)

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4-methylbenzenesulfonic acid;(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl) carbamimidothioate Basic Attributes

Molecular Weight：

384.6 g/mol

Exact Mass：

384.15413511 g/mol

NSC Number：

34553

Characteristics

PSA：

138 Å²

Computed Properties

Molecular Weight:384.6
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:384.15413511
Monoisotopic Mass:384.15413511
Topological Polar Surface Area:138
Heavy Atom Count:25
Complexity:481
Undefined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Guide of 4-methylbenzenesulfonic acid;(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl) carbamimidothioate

Basic Attributes
Characteristics
Computed Properties
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