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98896-96-9

98896-96-9 | 2-methoxy-4-thiazolidin-2-yl-phenol

CAS No: 98896-96-9 Catalog No: AG005TOJ MDL No:

Product Description

Catalog Number:
AG005TOJ
Chemical Name:
2-methoxy-4-thiazolidin-2-yl-phenol
CAS Number:
98896-96-9
Molecular Formula:
C10H13NO2S
Molecular Weight:
211.2807
IUPAC Name:
2-methoxy-4-(1,3-thiazolidin-2-yl)phenol
InChI:
InChI=1S/C10H13NO2S/c1-13-9-6-7(2-3-8(9)12)10-11-4-5-14-10/h2-3,6,10-12H,4-5H2,1H3
InChI Key:
ARBGBCQCAFWNDH-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1O)C1NCCS1

Properties

Complexity:
191  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.067g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
211.279g/mol
Monoisotopic Mass:
211.067g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  

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