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2- (Methylthio) -9H-carbazole

CAT: 0127-OR340087Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0127-OR340087Size:100 mg
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CAS Number
1607470-08-5
MDL Number
MFCD28154715
Purity
98%
Smiles
CSc1ccc2c(c1)[nH]c3ccccc23

Chemical Information

2-(Methylthio)-9H-carbazole
CAS Number1607470-08-5
PubChem CID112758321
IUPAC Name2-methylsulfanyl-9H-carbazole
Molecular FormulaC13H11NS
Molecular Weight213.30
XLogP4.4
Topological Polar Surface Area41.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count15
Formal Charge0
Complexity231
SMILES
CSC1=CC2=C(C=C1)C3=CC=CC=C3N2
InChI
InChI=1S/C13H11NS/c1-15-9-6-7-11-10-4-2-3-5-12(10)14-13(11)8-9/h2-8,14H,1H3
InChIKey
KCWQYCUYCXHSBK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(Methylthio)-9H-carbazole
CAS: 1607470-08-5
CID: 112758321
Formula: C13H11NS
MW: 213.30
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight213.30
XLogP34.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass213.06122053
Monoisotopic Mass213.06122053
Topological Polar Surface Area41.1 Ų
Heavy Atom Count15
Formal Charge0
Complexity231
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

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Alternative Products

CatalogName
TRC-M330745-1GN-[2-(Methylthio)ethyl]-2-[(3,3,3-trifluoropropyl)thio]-9H-purin-6-amine
RG-A260206-01(2R,3R,4S,5S) -2- (6-Amino-9H-Purin-9-Yl) -5- ((S) -1- (Methylthio) Ethyl) Tetrahydrofuran-3,4-Diol discontinued see RM-A555920
TRC-C176065-10G9H-Carbazole
18628-07-43- (9H-Carbazole-9-yl) -9H-carbazole
C91909H-Carbazole Ethanol
T77681-013-Methoxy-9H-Carbazole
MBS3617993-019H-Carbazole, 1-methyl-
sc-3374759H-Carbazole-2-carbaldehyde
MBS58265473-Iodo-9H-carbazole
sc-2684699-Isopropyl-9H-carbazole

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