Home Other Building Blocks 4-(propan-2-yloxy)benzene-1-carbothioamide

4-(propan-2-yloxy)benzene-1-carbothioamide

CAS No.:
144060-89-9
Catalog Number:
AG01A8FD
Molecular Formula:
C10H13NOS
Molecular Weight:
195.2813
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Product Description
Catalog Number:
AG01A8FD
Chemical Name:
4-(propan-2-yloxy)benzene-1-carbothioamide
CAS Number:
144060-89-9
Molecular Formula:
C10H13NOS
Molecular Weight:
195.2813
MDL Number:
MFCD09950634
IUPAC Name:
4-propan-2-yloxybenzenecarbothioamide
InChI:
InChI=1S/C10H13NOS/c1-7(2)12-9-5-3-8(4-6-9)10(11)13/h3-7H,1-2H3,(H2,11,13)
InChI Key:
TYUMBOSCTNGSIR-UHFFFAOYSA-N
SMILES:
CC(Oc1ccc(cc1)C(=S)N)C
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.072g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
195.28g/mol
Monoisotopic Mass:
195.072g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
67.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties