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88991-48-4

88991-48-4 | 5(4H)-Oxazolone, 2-methyl-4-[(5-methyl-2-thienyl)methylene]-, (Z)-

CAS No: 88991-48-4 Catalog No: AG00440K MDL No:

Product Description

Catalog Number:
AG00440K
Chemical Name:
5(4H)-Oxazolone, 2-methyl-4-[(5-methyl-2-thienyl)methylene]-, (Z)-
CAS Number:
88991-48-4
Molecular Formula:
C10H9NO2S
Molecular Weight:
207.2490
IUPAC Name:
2-methyl-4-[(5-methylthiophen-2-yl)methylidene]-1,3-oxazol-5-one
InChI:
InChI=1S/C10H9NO2S/c1-6-3-4-8(14-6)5-9-10(12)13-7(2)11-9/h3-5H,1-2H3
InChI Key:
IBCDTEOTMAZIGQ-UHFFFAOYSA-N
SMILES:
CC1=N/C(=C\c2ccc(s2)C)/C(=O)O1

Properties

Complexity:
322  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.035g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
207.247g/mol
Monoisotopic Mass:
207.035g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
2  

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