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DDTT

DDTT structure

DDTT 

structure
  • CAS No:

    1192027-04-5

  • Formula:

    C5H7N3S3

  • Chemical Name:

    DDTT

  • Synonyms:

    (E)-N,N-dimethyl-N'-(3-thioxo-3H-1,2,4-dithiazol-5-yl)formimidamide;3-((N,N-dimethylaminomethylidene)amino)-3H-1,2,4-dithiazole-5-thione;N,N-Dimethyl-N'-(3-thioxo-3H-1,2,4-dithiazol-5-yl)methanimidamide;[(Dimethylamino-methylidene)amino]-3H-1,2,4-dithiazoline-3-thione

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

DDTT Basic Attributes

205.32

204.980211

Characteristics

111

2.1555

1.46±0.1 g/cm3(Predicted)

178-179 °C(Solv: 1,4-dioxane (123-91-1))

293.9±23.0 °C(Predicted)

Safety Information

|Warning|H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P280, P301+P312, P305+P351+P338, P330, P337+P313, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:205.3
XLogP3:1.3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:204.98021076
Monoisotopic Mass:204.98021076
Topological Polar Surface Area:111
Heavy Atom Count:11
Complexity:221
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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