Home Carboxys 1-(Benzo[d]thiazol-2-yl)cyclopropanecarboxylic acid

1-(Benzo[d]thiazol-2-yl)cyclopropanecarboxylic acid

CAS No.:
869973-63-7
Catalog Number:
AG00IEAW
Molecular Formula:
C11H9NO2S
Molecular Weight:
219.2597
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$516
- +
1g
95%
1 week
United States
$1232
- +
Product Description
Catalog Number:
AG00IEAW
Chemical Name:
1-(Benzo[d]thiazol-2-yl)cyclopropanecarboxylic acid
CAS Number:
869973-63-7
Molecular Formula:
C11H9NO2S
Molecular Weight:
219.2597
MDL Number:
MFCD22690500
IUPAC Name:
1-(1,3-benzothiazol-2-yl)cyclopropane-1-carboxylic acid
InChI:
InChI=1S/C11H9NO2S/c13-10(14)11(5-6-11)9-12-7-3-1-2-4-8(7)15-9/h1-4H,5-6H2,(H,13,14)
InChI Key:
QUWHGOUREPPWBB-UHFFFAOYSA-N
SMILES:
OC(=O)C1(CC1)c1nc2c(s1)cccc2
Properties
Complexity:
290  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.035g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
219.258g/mol
Monoisotopic Mass:
219.035g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
78.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties