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Semicarbazide hydrochloride

CAT: 0931-T1732-01Size: 1 mL - 10 mM (in DMSO)Dry Ice: NoHazardous: No
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CAT#:0931-T1732-01Size:1 mL - 10 mM (in DMSO)
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
563-41-7
Target
Monoamine Oxidase, Antibiotic
Related Pathways
Neuroscience, Microbiology/Virology
Purity
>99.99%
Bioactivity
Semicarbazide hydrochloride is a urea derivative that binds to copper or iron in cells to produce antiviral, anti-infective and anti-tumor effects.
Smiles
Cl.NNC(N)=O
Molecular Formula
CH6ClN3O
Molecular Weight
111.53
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Semicarbazide hydrochloride

Semicarbazide hydrochloride is an organic molecular entity.

CAS Number563-41-7
PubChem CID11236
IUPAC Nameaminourea;hydrochloride
Molecular FormulaCH6ClN3O
Molecular Weight111.53
Topological Polar Surface Area81.1
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count6
Formal Charge0
Complexity42
SMILES
C(=O)(N)NN.Cl
InChI
InChI=1S/CH5N3O.ClH/c2-1(5)4-3;/h3H2,(H3,2,4,5);1H
InChIKey
XHQYBDSXTDXSHY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Semicarbazide hydrochloride
CAS: 563-41-7
CID: 11236
Formula: CH6ClN3O
MW: 111.53
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight111.53
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass111.0199395
Monoisotopic Mass111.0199395
Topological Polar Surface Area81.1 Ų
Heavy Atom Count6
Formal Charge0
Complexity42.2
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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