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114095-04-4

114095-04-4 | IMIDAZO[2,1-B]BENZOTHIAZOLE-2-CARBOXALDEHYDE

CAS No: 114095-04-4 Catalog No: AG000AJ9 MDL No:MFCD03644614

Product Description

Catalog Number:
AG000AJ9
Chemical Name:
IMIDAZO[2,1-B]BENZOTHIAZOLE-2-CARBOXALDEHYDE
CAS Number:
114095-04-4
Molecular Formula:
C10H6N2OS
Molecular Weight:
202.2324
MDL Number:
MFCD03644614
IUPAC Name:
imidazo[2,1-b][1,3]benzothiazole-2-carbaldehyde
InChI:
InChI=1S/C10H6N2OS/c13-6-7-5-12-8-3-1-2-4-9(8)14-10(12)11-7/h1-6H
InChI Key:
AYWXAXVILRRBCO-UHFFFAOYSA-N
SMILES:
O=Cc1cn2c(n1)sc1c2cccc1

Properties

Complexity:
248  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.02g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.231g/mol
Monoisotopic Mass:
202.02g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
62.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  

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