Name: Name:3-(3-chloro-2-fluorophenyl)isoxazole-5-carboxylic acid
Brand: Angene
SKU: AG01C0CU
Rating: 90 (10 reviews)

3-(3-chloro-2-fluorophenyl)isoxazole-5-carboxylic acid

CAS No.:

1126636-81-4

Catalog Number:

AG01C0CU

Molecular Formula:

C10H5ClFNO3

Molecular Weight:

241.6030

Catalog Number:

AG01C0CU

Chemical Name:

3-(3-chloro-2-fluorophenyl)isoxazole-5-carboxylic acid

CAS Number:

1126636-81-4

Molecular Formula:

C10H5ClFNO3

Molecular Weight:

241.6030

MDL Number:

MFCD11845410

IUPAC Name:

3-(3-chloro-2-fluorophenyl)-1,2-oxazole-5-carboxylic acid

InChI:

InChI=1S/C10H5ClFNO3/c11-6-3-1-2-5(9(6)12)7-4-8(10(14)15)16-13-7/h1-4H,(H,14,15)

InChI Key:

STLINEMAHUDACO-UHFFFAOYSA-N

SMILES:

OC(=O)c1onc(c1)c1cccc(c1F)Cl

Complexity:

279

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

240.994g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

241.602g/mol

Monoisotopic Mass:

240.994g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

63.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.6