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1344367-35-6 | 1-(4H,6H,7H-PYRANO[4,3-D][1,3]THIAZOL-2-YL)ETHAN-1-OL
CAS No: 1344367-35-6 Catalog No: AG01DVVY MDL No:MFCD18343940
Product Description
Catalog Number:
AG01DVVY
Chemical Name:
1-(4H,6H,7H-PYRANO[4,3-D][1,3]THIAZOL-2-YL)ETHAN-1-OL
CAS Number:
1344367-35-6
Molecular Formula:
C8H11NO2S
Molecular Weight:
185.2434
MDL Number:
MFCD18343940
IUPAC Name:
1-(6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-yl)ethanol
InChI:
InChI=1S/C8H11NO2S/c1-5(10)8-9-6-2-3-11-4-7(6)12-8/h5,10H,2-4H2,1H3
InChI Key:
KRISORPCWOQZAV-UHFFFAOYSA-N
SMILES:
CC(c1nc2c(s1)COCC2)O
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.051g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
185.241g/mol
Monoisotopic Mass:
185.051g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
70.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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