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Carbazochrome

CAT: 0572-TRC-C175820-25GSize: 25 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-C175820-25GSize:25 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
69-81-8
Synonyms
Adenochrome semicarbazone; Hydrazinecarboxamide, 2-(1,2,3,6-tetrahydro-3-hydroxy-1-methyl-6-oxo-5H-indol-5-ylidene)-; 5,6-Indolinedione, 3-hydroxy-1-methyl-, 5-semicarbazone (7CI,8CI); Adrenochrome semicarbazone (6CI); 2-(1,2,3,6-Tetrahydro-3-hydroxy-1-methyl-6-oxo-5H-indol-5-ylidene)hydrazinecarboxamide; 3-Hydroxy-1-methyl-5,6-indolindione 5-semicarbazone; Adchnon; Adedolon; Adrenochrome monosemicarbazone; Adrenostazin; Adrenoxyl; Adrezon; Adrokson; Adroxon; Carbazochrom; Carbazochrome; Cartabes; Cromadrenal; Cromosil; NSC 73742; Sangostasin; Sangostazin
Hazard Statement
Not a hazardous substance according to GHS.
Purity
>95% (HPLC)
Smiles
CN1CC(O)C2=CC(=NNC(=O)N)C(=O)C=C12
Molecular Formula
C10H12N4O3
Molecular Weight
236.23
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

Carbazochrome

Carbazochrome is a member of indoles. It is functionally related to a semicarbazide.

CAS Number69-81-8
PubChem CID2557
IUPAC Name(3,6-dihydroxy-1-methyl-2,3-dihydroindol-5-yl)iminourea
Molecular FormulaC10H12N4O3
Molecular Weight236.23
XLogP0
Topological Polar Surface Area112
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Heavy Atom Count17
Formal Charge0
Complexity336
SMILES
CN1CC(C2=CC(=C(C=C21)O)N=NC(=O)N)O
InChI
InChI=1S/C10H12N4O3/c1-14-4-9(16)5-2-6(12-13-10(11)17)8(15)3-7(5)14/h2-3,9,15-16H,4H2,1H3,(H2,11,17)
InChIKey
SSCSSDNTQJGTJT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Carbazochrome
CAS: 69-81-8
CID: 2557
Formula: C10H12N4O3
MW: 236.23
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight236.23
XLogP30
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Exact Mass236.09094026
Monoisotopic Mass236.09094026
Topological Polar Surface Area112 Ų
Heavy Atom Count17
Formal Charge0
Complexity336
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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