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73500-46-6 | 4H-1,3-Thiazine, 5,6-dihydro-2-(4-methoxyphenyl)-
CAS No: 73500-46-6 Catalog No: AG008QX2 MDL No:
Product Description
Catalog Number:
AG008QX2
Chemical Name:
4H-1,3-Thiazine, 5,6-dihydro-2-(4-methoxyphenyl)-
CAS Number:
73500-46-6
Molecular Formula:
C11H13NOS
Molecular Weight:
207.2920
IUPAC Name:
2-(4-methoxyphenyl)-5,6-dihydro-4H-1,3-thiazine
InChI:
InChI=1S/C11H13NOS/c1-13-10-5-3-9(4-6-10)11-12-7-2-8-14-11/h3-6H,2,7-8H2,1H3
InChI Key:
ZHWWMUGRPPNHGS-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C1=NCCCS1
Properties
Complexity:
209
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.072g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
207.291g/mol
Monoisotopic Mass:
207.072g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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