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1856178-66-9

1856178-66-9 | 1-[3-(1,2-thiazol-3-yl)phenyl]ethan-1-one

CAS No: 1856178-66-9 Catalog No: AG01CA00 MDL No:MFCD30199315

Product Description

Catalog Number:
AG01CA00
Chemical Name:
1-[3-(1,2-thiazol-3-yl)phenyl]ethan-1-one
CAS Number:
1856178-66-9
Molecular Formula:
C11H9NOS
Molecular Weight:
203.2603
MDL Number:
MFCD30199315
IUPAC Name:
1-[3-(1,2-thiazol-3-yl)phenyl]ethanone
InChI:
InChI=1S/C11H9NOS/c1-8(13)9-3-2-4-10(7-9)11-5-6-14-12-11/h2-7H,1H3
InChI Key:
VPQSRHZSLAMGTO-UHFFFAOYSA-N
SMILES:
CC(=O)c1cccc(c1)c1nscc1

Properties

Complexity:
219  
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:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  

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