Home Carbonyls 1-(Thiophene-2-carbonyl)-1H-1,2,3-benzotriazole

1-(Thiophene-2-carbonyl)-1H-1,2,3-benzotriazole

CAS No.:
301164-69-2
Catalog Number:
AG007JIH
Molecular Formula:
C11H7N3OS
Molecular Weight:
229.2578
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
1 week
United States
$66
- +
1g
98%
1 week
United States
$87
- +
5g
98%
1 week
United States
$184
- +
Product Description
Catalog Number:
AG007JIH
Chemical Name:
1-(Thiophene-2-carbonyl)-1H-1,2,3-benzotriazole
CAS Number:
301164-69-2
Molecular Formula:
C11H7N3OS
Molecular Weight:
229.2578
MDL Number:
MFCD00583990
IUPAC Name:
benzotriazol-1-yl(thiophen-2-yl)methanone
InChI:
InChI=1S/C11H7N3OS/c15-11(10-6-3-7-16-10)14-9-5-2-1-4-8(9)12-13-14/h1-7H
InChI Key:
NPHXTBJFXYNMCF-UHFFFAOYSA-N
SMILES:
O=C(n1nnc2c1cccc2)c1cccs1
Properties
Complexity:
286  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.031g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.257g/mol
Monoisotopic Mass:
229.031g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
76A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties