Home Other Building Blocks 4-cyclobutoxybenzene-1-carbothioamide

4-cyclobutoxybenzene-1-carbothioamide

CAS No.:
1247109-10-9
Catalog Number:
AG01BFTJ
Molecular Formula:
C11H13NOS
Molecular Weight:
207.2920
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Product Description
Catalog Number:
AG01BFTJ
Chemical Name:
4-cyclobutoxybenzene-1-carbothioamide
CAS Number:
1247109-10-9
Molecular Formula:
C11H13NOS
Molecular Weight:
207.2920
MDL Number:
MFCD16684499
IUPAC Name:
4-cyclobutyloxybenzenecarbothioamide
InChI:
InChI=1S/C11H13NOS/c12-11(14)8-4-6-10(7-5-8)13-9-2-1-3-9/h4-7,9H,1-3H2,(H2,12,14)
InChI Key:
DQWWWXFYQWWANF-UHFFFAOYSA-N
SMILES:
NC(=S)c1ccc(cc1)OC1CCC1
Properties
Complexity:
207  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.072g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
207.291g/mol
Monoisotopic Mass:
207.072g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
67.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties