Basic information
- CAS
3545-42-4- Standard SMILES
Br.CCCCCCCCCCCCSC(=N)N- InChIKey
WFERTJGZWKWNMF-UHFFFAOYSA-N- Molecular formula
- C13H29BrN2S
- Average molar mass
- 325.35 g/mol
- Monoisotopic mass
- 324.12348
Names & identifiers
- Preferred name
- (Dodecylsulfanyl)methanimidamide hydrobromide
- IUPAC
- dodecyl carbamimidothioate;hydrobromide
- English name
- Dodecylthiouroniumbromide
- Molecular formula
- C13H28N2S.BrH
- Molecular weight
- 325.35
Names & synonyms
(dodecylsulfanyl)methanimidamide hydrobromideCarbamimidothioic acid, dodecyl ester, hydrobromide (1:1)RefChem:406213964-510-33545-42-4Laurylisothiuronium bromidedodecyl carbamimidothioate hydrobromideS-Dodecylthiuronium bromidedodecyl carbamimidothioate;hydrobromideNSC 3505DODECYLTHIOURONIUMBROMIDEAI3-19864
Show more names
dodecyl carbamimidothioate,hydrobromidePSEUDOUREA,2-DODECYL-2-THIO-,HYDROBROMIDE
Pseudourea, 2-dodecyl-2-thio-, hydrobromideCarbamimidothioic acid, dodecyl ester, monohydrobromideWLN: MUYZS12 &EHSCHEMBL9841020DTXSID80188956NSC3505Carbamimidothioic acid, dodecyl ester, monohydrobromide (9CI)dodecylcarbamimidothioatehydrobromide
Database identifiers
- CAS
3545-42-4- PubChem CID
- 77086
- DTXSID
DTXSID80188956- EC Number
- 964-510-3
Properties
Computed structural properties
- Topological polar surface area
- 75.2 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 12
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 160
Physicochemical properties
- Melting point
- 111 °C · 111 °C
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers1 total
陕西缔都化学有限公司17691182729 17392216275 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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