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100370-71-6

100370-71-6 | 1,2-Benzenediol, 4-(3,6-dimethyl-2-morpholinyl)-

CAS No: 100370-71-6 Catalog No: AG0001RI MDL No:

Product Description

Catalog Number:
AG0001RI
Chemical Name:
1,2-Benzenediol, 4-(3,6-dimethyl-2-morpholinyl)-
CAS Number:
100370-71-6
Molecular Formula:
C12H17NO3
Molecular Weight:
223.2683
IUPAC Name:
4-(3,6-dimethylmorpholin-2-yl)benzene-1,2-diol
InChI:
InChI=1S/C12H17NO3/c1-7-6-13-8(2)12(16-7)9-3-4-10(14)11(15)5-9/h3-5,7-8,12-15H,6H2,1-2H3
InChI Key:
COYDOKLRNWKQTK-UHFFFAOYSA-N
SMILES:
CC1CNC(C(O1)c1ccc(c(c1)O)O)C

Properties

Complexity:
236  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.121g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
223.272g/mol
Monoisotopic Mass:
223.121g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
61.7A^2
Undefined Atom Stereocenter Count:
3  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  

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