Home Other Building Blocks [4-(ethynylsulfanyl)phenyl]methanol

[4-(ethynylsulfanyl)phenyl]methanol

CAS No.:
1803601-75-3
Catalog Number:
AG01BCUK
Molecular Formula:
C9H8OS
Molecular Weight:
164.2242
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Product Description
Catalog Number:
AG01BCUK
Chemical Name:
[4-(ethynylsulfanyl)phenyl]methanol
CAS Number:
1803601-75-3
Molecular Formula:
C9H8OS
Molecular Weight:
164.2242
MDL Number:
MFCD28012319
IUPAC Name:
(4-ethynylsulfanylphenyl)methanol
InChI:
InChI=1S/C9H8OS/c1-2-11-9-5-3-8(7-10)4-6-9/h1,3-6,10H,7H2
InChI Key:
RDDKZTZGQNMEQJ-UHFFFAOYSA-N
SMILES:
OCc1ccc(cc1)SC#C
Properties
Complexity:
150  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.03g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
164.222g/mol
Monoisotopic Mass:
164.03g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
45.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties