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6638-35-3 | 2-phenyl-5,6-dihydro-4h-1,3-thiazine
CAS No: 6638-35-3 Catalog No: AG006MCH MDL No:
Product Description
Catalog Number:
AG006MCH
Chemical Name:
2-phenyl-5,6-dihydro-4h-1,3-thiazine
CAS Number:
6638-35-3
Molecular Formula:
C10H11NS
Molecular Weight:
177.2660
IUPAC Name:
2-phenyl-5,6-dihydro-4H-1,3-thiazine
InChI:
InChI=1S/C10H11NS/c1-2-5-9(6-3-1)10-11-7-4-8-12-10/h1-3,5-6H,4,7-8H2
InChI Key:
SCNUDNWHYDSILO-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)C1=NCCCS1
NSC Number:
48049
Properties
Complexity:
171
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.061g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
177.265g/mol
Monoisotopic Mass:
177.061g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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