Home Other Building Blocks 4-Hydroxy-3-methylphenyl thiocyanate

4-Hydroxy-3-methylphenyl thiocyanate

CAS No.:
3774-53-6
Catalog Number:
AG00C8HH
Molecular Formula:
C8H7NOS
Molecular Weight:
165.2123
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
1 week
United States
$112
- +
5g
95%
1 week
United States
$260
- +
Product Description
Catalog Number:
AG00C8HH
Chemical Name:
4-Hydroxy-3-methylphenyl thiocyanate
CAS Number:
3774-53-6
Molecular Formula:
C8H7NOS
Molecular Weight:
165.2123
MDL Number:
MFCD00086627
IUPAC Name:
(4-hydroxy-3-methylphenyl) thiocyanate
InChI:
InChI=1S/C8H7NOS/c1-6-4-7(11-5-9)2-3-8(6)10/h2-4,10H,1H3
InChI Key:
WEAMLHXSIBDPGN-UHFFFAOYSA-N
SMILES:
N#CSc1ccc(c(c1)C)O
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.025g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
165.21g/mol
Monoisotopic Mass:
165.025g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
69.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties