Home Other Building Blocks 4-propoxybenzene-1-carbothioamide

4-propoxybenzene-1-carbothioamide

CAS No.:
60758-95-4
Catalog Number:
AG01A8HU
Molecular Formula:
C10H13NOS
Molecular Weight:
195.2813
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Product Description
Catalog Number:
AG01A8HU
Chemical Name:
4-propoxybenzene-1-carbothioamide
CAS Number:
60758-95-4
Molecular Formula:
C10H13NOS
Molecular Weight:
195.2813
MDL Number:
MFCD08164116
IUPAC Name:
4-propoxybenzenecarbothioamide
InChI:
InChI=1S/C10H13NOS/c1-2-7-12-9-5-3-8(4-6-9)10(11)13/h3-6H,2,7H2,1H3,(H2,11,13)
InChI Key:
LAZWLBJBNOPJQW-UHFFFAOYSA-N
SMILES:
CCCOc1ccc(cc1)C(=S)N
NSC Number:
281622
Properties
Complexity:
164  
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:
4  
Topological Polar Surface Area:
67.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties