Home Other Building Blocks [2-(1,3-benzothiazol-2-yl)ethenyl]dimethylamine

[2-(1,3-benzothiazol-2-yl)ethenyl]dimethylamine

CAS No.:
1173888-05-5
Catalog Number:
AG01ACCI
Molecular Formula:
C11H12N2S
Molecular Weight:
204.2914
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Product Description
Catalog Number:
AG01ACCI
Chemical Name:
[2-(1,3-benzothiazol-2-yl)ethenyl]dimethylamine
CAS Number:
1173888-05-5
Molecular Formula:
C11H12N2S
Molecular Weight:
204.2914
IUPAC Name:
(E)-2-(1,3-benzothiazol-2-yl)-N,N-dimethylethenamine
InChI:
InChI=1S/C11H12N2S/c1-13(2)8-7-11-12-9-5-3-4-6-10(9)14-11/h3-8H,1-2H3/b8-7+
InChI Key:
QWNOLXNQHADUHK-BQYQJAHWSA-N
SMILES:
CN(C=Cc1nc2c(s1)cccc2)C
Properties
Complexity:
215  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
204.072g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.291g/mol
Monoisotopic Mass:
204.072g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
44.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties