Home Nitriles 2-amino-6-methoxy-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile

2-amino-6-methoxy-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile

CAS No.:
13145-85-2
Catalog Number:
AG01AM9B
Molecular Formula:
C10H12N2OS
Molecular Weight:
208.2801
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01AM9B
Chemical Name:
2-amino-6-methoxy-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
CAS Number:
13145-85-2
Molecular Formula:
C10H12N2OS
Molecular Weight:
208.2801
MDL Number:
MFCD24630054
IUPAC Name:
2-amino-6-methoxy-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
InChI:
InChI=1S/C10H12N2OS/c1-13-6-2-3-7-8(5-11)10(12)14-9(7)4-6/h6H,2-4,12H2,1H3
InChI Key:
QHJAFTPWGIVJEJ-UHFFFAOYSA-N
SMILES:
COC1CCc2c(C1)sc(c2C#N)N
Properties
Complexity:
262  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.067g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
208.279g/mol
Monoisotopic Mass:
208.067g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
87.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties