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1803593-52-3

1803593-52-3 | 2-(morpholin-3-yl)-1,3-benzothiazole hydrochloride

CAS No: 1803593-52-3 Catalog No: AG01B8LC MDL No:MFCD28246554

Product Description

Catalog Number:
AG01B8LC
Chemical Name:
2-(morpholin-3-yl)-1,3-benzothiazole hydrochloride
CAS Number:
1803593-52-3
Molecular Formula:
C11H13ClN2OS
Molecular Weight:
256.7517
MDL Number:
MFCD28246554
IUPAC Name:
3-(1,3-benzothiazol-2-yl)morpholine;hydrochloride
InChI:
InChI=1S/C11H12N2OS.ClH/c1-2-4-10-8(3-1)13-11(15-10)9-7-14-6-5-12-9;/h1-4,9,12H,5-7H2;1H
InChI Key:
LHQQXTQZPVWAAD-UHFFFAOYSA-N
SMILES:
C1CNC(CO1)c1nc2c(s1)cccc2.Cl

Properties

Complexity:
227  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.044g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
256.748g/mol
Monoisotopic Mass:
256.044g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
62.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0

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