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Cystamine

CAT: 0127-BUP11270-06Size: 2 gDry Ice: NoHazardous: No
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CAT#:0127-BUP11270-06Size:2 g
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CAS Number
51-85-4
Synonyms
2,2'-Disulfanediyldiethanamine
Purity
=98%
Smiles
NCCSSCCN

Chemical Information

Cystamine

Cystamine is an organic disulfide obtgained by oxidative dimerisation of cysteamine. It has a role as an EC 2.3.2.13 (protein-glutamine gamma-glutamyltransferase) inhibitor. It is an organic disulfide and a primary amino compound. It is functionally related to a cysteamine.

CAS Number51-85-4
PubChem CID2915
IUPAC Name2-(2-aminoethyldisulfanyl)ethanamine
Molecular FormulaC4H12N2S2
Molecular Weight152.3
XLogP-1
Topological Polar Surface Area103
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count8
Formal Charge0
Complexity37
SMILES
C(CSSCCN)N
InChI
InChI=1S/C4H12N2S2/c5-1-3-7-8-4-2-6/h1-6H2
InChIKey
APQPRKLAWCIJEK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Cystamine
CAS: 51-85-4
CID: 2915
Formula: C4H12N2S2
MW: 152.3
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight152.3
XLogP3-1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass152.04419074
Monoisotopic Mass152.04419074
Topological Polar Surface Area103 Ų
Heavy Atom Count8
Formal Charge0
Complexity37
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes