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Guanidinoethyldisulfide

HCID 176516630
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
1072-13-5
Standard SMILES
N=C(N)NCCSSCCN=C(N)N
InChIKey
IRMTXMJNHRISQH-UHFFFAOYSA-N
Molecular formula
C6H16N6S2
Average molar mass
236.4 g/mol
Monoisotopic mass
236.08778688

Names & identifiers

Preferred name
Guanidinoethyldisulfide
IUPAC
1-[2-[2-(diaminomethylideneamino)ethyldisulfanyl]ethyl]guanidine
English name
Guanidinoethyl disulfide
Molecular formula
C6H16N6S2
Molecular weight
236.36

Names & synonyms

guanidinoethyldisulfide1,1'-(Disulfanediylbis(ethane-2,1-diyl))diguanidineGuanidoethyl disulfideUNII-ON58WN42P2Bis(2-guanidoethyl)disulphideSCHEMBL145590CHEMBL105278orb3136625guanidinoethyldisulfide-bicarbonateBIS(2-GUANIDOETHYL) DISULFIDEDB-230504N,N'-(Dithiodi-2,1-ethanediyl)bisguanidine
Show more names
GEDguanylcystamineGED dihydrobromideguanidoethyldisulfide2-guanidinoethyldisulfidebis(2-guanidinoethyl)disulfideBis(2-guanidinoethyl) persulfide1,1’-(dithiodiethylene)di-guanidin
CYSTAMINE, N,N'-BIS(AMINOIMINOMETHYL)-Guanidine, N,N'-(dithiodi-2,1-ethanediyl)bis-guanidine, n,n'''-(dithiodi-2,1-ethanediyl)bis-T212243

Database identifiers

CAS
1072-13-5
PubChem CID
176516630
ChEMBL
CHEMBL105278
UNII
ON58WN42P2
Nikkaji
J78.491E

Properties

Computed structural properties

XLogP
-1.8
Topological polar surface area
177 Ų
Hydrogen bond donors
5
Hydrogen bond acceptors
4
Rotatable bonds
8
Heavy atoms
14
Formal charge
0
Complexity
191

Physicochemical properties

Density
1.2 · 1.200 (estimate)
refractive index
1.55 · 1.5500 (estimate)
storage temp.
2 · 2-8°C
FDA UNII
58 WN42P2 · ON58WN42P2
RTECS
1310000 · MF1310000

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

rtecs
MF1310000

Chemistry & industry

Suppliers3 total

河南伊诺凯新材料有限公司15670530983 · [email protected]
上海鑫圭生物科技有限公司15121041756 · [email protected]
东阳市求索医药科技有限公司17502510579 · [email protected]

Related reactions

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Compound notes

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