Home Other Building Blocks 4-Methoxybenzo[d]oxazole-2-thiol

4-Methoxybenzo[d]oxazole-2-thiol

CAS No.:
1246471-39-5
Catalog Number:
AG000MIN
Molecular Formula:
C8H7NO2S
Molecular Weight:
181.2117
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$234
- +
1g
95%
1 week
United States
$528
- +
5g
95%
1 week
United States
$1509
- +
Product Description
Catalog Number:
AG000MIN
Chemical Name:
4-Methoxybenzo[d]oxazole-2-thiol
CAS Number:
1246471-39-5
Molecular Formula:
C8H7NO2S
Molecular Weight:
181.2117
MDL Number:
MFCD17171374
IUPAC Name:
4-methoxy-3H-1,3-benzoxazole-2-thione
InChI:
InChI=1S/C8H7NO2S/c1-10-5-3-2-4-6-7(5)9-8(12)11-6/h2-4H,1H3,(H,9,12)
InChI Key:
KNQYHNDFKVAMEI-UHFFFAOYSA-N
SMILES:
COc1cccc2c1[nH]c(=S)o2
Properties
Complexity:
198  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.02g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
181.209g/mol
Monoisotopic Mass:
181.02g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
62.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties