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100207-46-3 | 1-Propanone, 1-(2-methyl-3-thienyl)-
CAS No: 100207-46-3 Catalog No: AG00018P MDL No:MFCD22574946
Product Description
Catalog Number:
AG00018P
Chemical Name:
1-Propanone, 1-(2-methyl-3-thienyl)-
CAS Number:
100207-46-3
Molecular Formula:
C8H10OS
Molecular Weight:
154.2294
MDL Number:
MFCD22574946
IUPAC Name:
1-(2-methylthiophen-3-yl)propan-1-one
InChI:
InChI=1S/C8H10OS/c1-3-8(9)7-4-5-10-6(7)2/h4-5H,3H2,1-2H3
InChI Key:
RGZHXPXCYDKTPV-UHFFFAOYSA-N
SMILES:
CCC(=O)c1ccsc1C
Properties
Complexity:
133
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.045g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
154.227g/mol
Monoisotopic Mass:
154.045g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
45.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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