Home Carboxys 1-(2-Chlorophenyl)isoquinoline-3-carboxylic acid

1-(2-Chlorophenyl)isoquinoline-3-carboxylic acid

CAS No.:
89242-09-1
Catalog Number:
AG0042MD
Molecular Formula:
C16H10ClNO2
Molecular Weight:
283.7091
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$381
- +
1g
95%
1 week
United States
$896
- +
Product Description
Catalog Number:
AG0042MD
Chemical Name:
1-(2-Chlorophenyl)isoquinoline-3-carboxylic acid
CAS Number:
89242-09-1
Molecular Formula:
C16H10ClNO2
Molecular Weight:
283.7091
MDL Number:
MFCD17169230
IUPAC Name:
1-(2-chlorophenyl)isoquinoline-3-carboxylic acid
InChI:
InChI=1S/C16H10ClNO2/c17-13-8-4-3-7-12(13)15-11-6-2-1-5-10(11)9-14(18-15)16(19)20/h1-9H,(H,19,20)
InChI Key:
JBRVJPXJLHEUND-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc2ccccc2c(n1)c1ccccc1Cl
Properties
Complexity:
362  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.04g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
283.711g/mol
Monoisotopic Mass:
283.04g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3  
Properties