Home Other Building Blocks 1-(Tetrahydro-1,1-dioxido-3-thienyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1h-pyrazole

1-(Tetrahydro-1,1-dioxido-3-thienyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1h-pyrazole

CAS No.:
1233526-31-2
Catalog Number:
AG000KFG
Molecular Formula:
C13H21BN2O4S
Molecular Weight:
312.1928
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
97%
1 week
United States
$242
- +
250mg
97%
1 week
United States
$446
- +
1g
97%
1 week
United States
$1062
- +
5g
97%
1 week
United States
$3095
- +
10g
97%
1 week
United States
$5184
- +
Product Description
Catalog Number:
AG000KFG
Chemical Name:
1-(Tetrahydro-1,1-dioxido-3-thienyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1h-pyrazole
CAS Number:
1233526-31-2
Molecular Formula:
C13H21BN2O4S
Molecular Weight:
312.1928
MDL Number:
MFCD18383245
IUPAC Name:
3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]thiolane 1,1-dioxide
InChI:
InChI=1S/C13H21BN2O4S/c1-12(2)13(3,4)20-14(19-12)10-7-15-16(8-10)11-5-6-21(17,18)9-11/h7-8,11H,5-6,9H2,1-4H3
InChI Key:
IAJQUMAICKULHC-UHFFFAOYSA-N
SMILES:
O=S1(=O)CCC(C1)n1ncc(c1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
501  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
312.132g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
312.191g/mol
Monoisotopic Mass:
312.132g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
78.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties