Home Other Building Blocks 6-(thiophen-2-yl)hexanoic acid

6-(thiophen-2-yl)hexanoic acid

CAS No.:
21010-07-1
Catalog Number:
AG01AH30
Molecular Formula:
C10H14O2S
Molecular Weight:
198.2820
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Product Description
Catalog Number:
AG01AH30
Chemical Name:
6-(thiophen-2-yl)hexanoic acid
CAS Number:
21010-07-1
Molecular Formula:
C10H14O2S
Molecular Weight:
198.2820
MDL Number:
MFCD12172599
IUPAC Name:
6-thiophen-2-ylhexanoic acid
InChI:
InChI=1S/C10H14O2S/c11-10(12)7-3-1-2-5-9-6-4-8-13-9/h4,6,8H,1-3,5,7H2,(H,11,12)
InChI Key:
QGRMMRTWWJNTMT-UHFFFAOYSA-N
SMILES:
OC(=O)CCCCCc1cccs1
Properties
Complexity:
159  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.071g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
198.28g/mol
Monoisotopic Mass:
198.071g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
65.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties