Name: Name:4-chloro-2-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]aniline
Brand: Angene
SKU: AG019YPY
Rating: 90 (10 reviews)

4-chloro-2-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]aniline

CAS No.:

1040079-81-9

Catalog Number:

AG019YPY

Molecular Formula:

C11H12ClN3O

Molecular Weight:

237.6855

Catalog Number:

AG019YPY

Chemical Name:

4-chloro-2-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]aniline

CAS Number:

1040079-81-9

Molecular Formula:

C11H12ClN3O

Molecular Weight:

237.6855

MDL Number:

MFCD11124605

IUPAC Name:

4-chloro-2-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)aniline

InChI:

InChI=1S/C11H12ClN3O/c1-6(2)10-14-11(16-15-10)8-5-7(12)3-4-9(8)13/h3-6H,13H2,1-2H3

InChI Key:

BVIZGIREMGPFLW-UHFFFAOYSA-N

SMILES:

Clc1ccc(c(c1)c1onc(n1)C(C)C)N

Complexity:

239

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

237.067g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

237.687g/mol

Monoisotopic Mass:

237.067g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

64.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.9