Home Other Building Blocks rac-1-[(1R,2R)-2-(thiophen-2-yl)cyclopropyl]ethan-1-one, trans

rac-1-[(1R,2R)-2-(thiophen-2-yl)cyclopropyl]ethan-1-one, trans

CAS No.:
134198-07-5
Catalog Number:
AG01C3NK
Molecular Formula:
C9H10OS
Molecular Weight:
166.2401
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Product Description
Catalog Number:
AG01C3NK
Chemical Name:
rac-1-[(1R,2R)-2-(thiophen-2-yl)cyclopropyl]ethan-1-one, trans
CAS Number:
134198-07-5
Molecular Formula:
C9H10OS
Molecular Weight:
166.2401
MDL Number:
MFCD28383850
IUPAC Name:
1-[(1R,2S)-2-thiophen-2-ylcyclopropyl]ethanone
InChI:
InChI=1S/C9H10OS/c1-6(10)7-5-8(7)9-3-2-4-11-9/h2-4,7-8H,5H2,1H3/t7-,8-/m0/s1
InChI Key:
KQFRWDSOHCFHFQ-YUMQZZPRSA-N
SMILES:
CC(=O)[C@@H]1C[C@H]1c1cccs1
Properties
Complexity:
178  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
166.045g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
166.238g/mol
Monoisotopic Mass:
166.045g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
45.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties