[(Diphenylmethyl)sulfanyl]methanimidamide hydrobromide
Basic information
- CAS
90280-15-2- Standard SMILES
Br.N=C(N)SC(c1ccccc1)c1ccccc1- InChIKey
OACCNOFVFDJYEJ-UHFFFAOYSA-N- Molecular formula
- C14H15BrN2S
- Average molar mass
- 323.25 g/mol
- Monoisotopic mass
- 322.01393
Names & identifiers
- Preferred name
- [(Diphenylmethyl)sulfanyl]methanimidamide hydrobromide
- IUPAC
- benzhydryl carbamimidothioate;hydrobromide
- English name
- [(Diphenylmethyl)sulfanyl]methanimidamide hydrobromide
- Molecular formula
- C14H14N2S.BrH
- Molecular weight
- 323.25
Names & synonyms
90280-15-2[(diphenylmethyl)sulfanyl]methanimidamide hydrobromidebenzhydryl carbamimidothioate hydrobromideMFCD00137024benzhydryl carbamimidothioate;hydrobromidebenzhydryl imidothiocarbamate hydrobromideXM8M7ZXR3ASCHEMBL50656882-benzhydrylisothiourea;hydrobromideNSC12019NSC-12019AKOS015833564
Show more names
diphenylmethylisothiouronium bromide2-BENZHYDRYL-2-THIOPSEUDOUREA HYDROBROMIDE[(Diphenylmethyl)sulfanyl]methanimidamide hydrochloride
benzhydrylcarbamimidothioatehydrobromideNE-0059Diphenylmethyl-S-isothiuronium hydrobromideCS-0368264Carbamimidothioic acid, diphenylmethyl ester, monohydrobromideCarbamimidothioic acid, diphenylmethyl ester, hydrobromide (1:1)
Database identifiers
- CAS
90280-15-2- PubChem CID
- 458387
- UNII
- XM8M7ZXR3A
Properties
Computed structural properties
- Topological polar surface area
- 75.2 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 225
Physicochemical properties
- Melting point
- 180 · 180-182 °C(Solv: ethanol (64-17-5); ethyl ether (60-29-7))
- HazardClass
- IRRITANT
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hazard_class
- IRRITANT
Chemistry & industry
Upstream & downstream products
Upstream raw materials
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Related reactions
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Compound notes
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