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72856-34-9

72856-34-9 | 6H-1,3-Thiazine-5-carboxaldehyde, 2-phenyl-

CAS No: 72856-34-9 Catalog No: AG005O1O MDL No:

Product Description

Catalog Number:
AG005O1O
Chemical Name:
6H-1,3-Thiazine-5-carboxaldehyde, 2-phenyl-
CAS Number:
72856-34-9
Molecular Formula:
C11H9NOS
Molecular Weight:
203.2603
IUPAC Name:
2-phenyl-6H-1,3-thiazine-5-carbaldehyde
InChI:
InChI=1S/C11H9NOS/c13-7-9-6-12-11(14-8-9)10-4-2-1-3-5-10/h1-7H,8H2
InChI Key:
PTXAQCIPEBWGKD-UHFFFAOYSA-N
SMILES:
O=CC1=CN=C(SC1)c1ccccc1

Properties

Complexity:
277  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.04g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
203.259g/mol
Monoisotopic Mass:
203.04g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  

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