Home Other Building Blocks 1-[5-(cyclopropylmethyl)thiophen-2-yl]ethan-1-one

1-[5-(cyclopropylmethyl)thiophen-2-yl]ethan-1-one

CAS No.:
2138123-11-0
Catalog Number:
AG01EJZA
Molecular Formula:
C10H12OS
Molecular Weight:
180.2667
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Product Description
Catalog Number:
AG01EJZA
Chemical Name:
1-[5-(cyclopropylmethyl)thiophen-2-yl]ethan-1-one
CAS Number:
2138123-11-0
Molecular Formula:
C10H12OS
Molecular Weight:
180.2667
MDL Number:
MFCD31559220
IUPAC Name:
1-[5-(cyclopropylmethyl)thiophen-2-yl]ethanone
InChI:
InChI=1S/C10H12OS/c1-7(11)10-5-4-9(12-10)6-8-2-3-8/h4-5,8H,2-3,6H2,1H3
InChI Key:
XBUSSPLRVWBRTM-UHFFFAOYSA-N
SMILES:
CC(=O)c1ccc(s1)CC1CC1
Properties
Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.061g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
180.265g/mol
Monoisotopic Mass:
180.061g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
45.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties