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1339178-64-1

1339178-64-1 | 4H,6H,7H-pyrano[4,3-d][1,3]thiazole-2-carbaldehyde

CAS No: 1339178-64-1 Catalog No: AG01BAYF MDL No:MFCD17251106

Product Description

Catalog Number:
AG01BAYF
Chemical Name:
4H,6H,7H-pyrano[4,3-d][1,3]thiazole-2-carbaldehyde
CAS Number:
1339178-64-1
Molecular Formula:
C7H7NO2S
Molecular Weight:
169.2010
MDL Number:
MFCD17251106
IUPAC Name:
6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazole-2-carbaldehyde
InChI:
InChI=1S/C7H7NO2S/c9-3-7-8-5-1-2-10-4-6(5)11-7/h3H,1-2,4H2
InChI Key:
FRKPPSJVZYIRPN-UHFFFAOYSA-N
SMILES:
O=Cc1nc2c(s1)COCC2

Properties

Complexity:
165  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.02g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
169.198g/mol
Monoisotopic Mass:
169.02g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  

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